1-phenyl-3-[2-(phenylcarbamothioylamino)ethyl]thiourea

Systemtic Name: 1-phenyl-3-[2-(phenylcarbamothioylamino)ethyl]thiourea Openeye Name: 1-phenyl-3-[2-(phenylcarbamothioylamino)ethyl]thiourea CAS Name: 1-[2-[[anilino(sulfanylidene)methyl]amino]ethyl]-3-phenylthiourea IUPAC Name: 1-phenyl-3-[2-(phenylcarbamothioylamino)ethyl]thiourea Traditional Name: 1-phenyl-3-[2-(phenylthiocarbamoylamino)ethyl]thiourea Formula: C16H18N4S2 MolecularWeight: 330.47092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NCCNC(=S)NC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NCCNC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C16H18N4S2/c21-15(19-13-7-3-1-4-8-13)17-11-12-18-16(22)20-14-9-5-2-6-10-14/h1-10H,11-12H2,(H2,17,19,21)(H2,18,20,22)