N-phenylbenzenecarbothioamide

N-phenylbenzenecarbothioamide

CAS: 636-04-4

Formula: C13H11NS

SMILES: S=C(NC1=CC=CC=C1)C1=CC=CC=C1

IUPAC: N-phenylbenzenecarbothioamide

InChI: InChI=1S/C13H11NS/c15-13(11-7-3-1-4-8-11)14-12-9-5-2-6-10-12/h1-10H,(H,14,15)

Composition: C (73.20%), H (5.20%), N (6.57%), S (15.03%)

Molar Mass: 213.3

Atom Count: 26

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	213.061220532
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	1
InChIKey	BOQKCADLPNLYCZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	69.58
Topological Polar Surface Area	12.03
Polarizability	26.42
Ring Count	2
Rotatable Bond Count	2

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