1-phenyl-3-[2-(phenylmethylsulfanyl)ethanoylamino]thiourea

Systemtic Name: 1-phenyl-3-[2-(phenylmethylsulfanyl)ethanoylamino]thiourea Openeye Name: 1-[(2-benzylsulfanylacetyl)amino]-3-phenyl-thiourea CAS Name: 1-[[1-oxo-2-(phenylmethylthio)ethyl]amino]-3-phenylthiourea IUPAC Name: 1-[(2-benzylsulfanylacetyl)amino]-3-phenylthiourea Traditional Name: 1-[[2-(benzylthio)acetyl]amino]-3-phenyl-thiourea Formula: C16H17N3OS2 MolecularWeight: 331.45568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(=O)NNC(=S)NC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CSCC(=O)NNC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C16H17N3OS2/c20-15(12-22-11-13-7-3-1-4-8-13)18-19-16(21)17-14-9-5-2-6-10-14/h1-10H,11-12H2,(H,18,20)(H2,17,19,21)