benzoylthiourea

benzoylthiourea

CAS: 614-23-3

Formula: C8H8N2OS

SMILES: NC(=S)NC(=O)C1=CC=CC=C1

IUPAC: benzoylthiourea

InChI: InChI=1S/C8H8N2OS/c9-8(12)10-7(11)6-4-2-1-3-5-6/h1-5H,(H3,9,10,11,12)

Composition: C (53.32%), H (4.47%), N (15.54%), O (8.88%), S (17.79%)

Molar Mass: 180.23

Atom Count: 20

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	180.03573406
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
InChIKey	DQMWMUMCNOJLSI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.37
Topological Polar Surface Area	55.12
Polarizability	19.57
Ring Count	1
Rotatable Bond Count	1

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