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88766-58-9 | Benzenamine, N-methyl-N-[[(methylphenylamino)carbonyl]dithio]-
CAS No: 88766-58-9 Catalog No: AG004BG6 MDL No:
Product Description
Catalog Number:
AG004BG6
Chemical Name:
Benzenamine, N-methyl-N-[[(methylphenylamino)carbonyl]dithio]-
CAS Number:
88766-58-9
Molecular Formula:
C15H16N2OS2
Molecular Weight:
304.4303
IUPAC Name:
S-(N-methylanilino)sulfanyl N-methyl-N-phenylcarbamothioate
InChI:
InChI=1S/C15H16N2OS2/c1-16(13-9-5-3-6-10-13)15(18)19-20-17(2)14-11-7-4-8-12-14/h3-12H,1-2H3
InChI Key:
CTOHCZQHWLVUID-UHFFFAOYSA-N
SMILES:
O=C(N(c1ccccc1)C)SSN(c1ccccc1)C
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.07g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.426g/mol
Monoisotopic Mass:
304.07g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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