1-[[4-oxidanylidene-4-[2-(phenylcarbamothioyl)hydrazinyl]butanoyl]amino]-3-phenyl-thiourea

Systemtic Name: 1-[[4-oxidanylidene-4-[2-(phenylcarbamothioyl)hydrazinyl]butanoyl]amino]-3-phenyl-thiourea Openeye Name: 1-[[4-oxo-4-[2-(phenylcarbamothioyl)hydrazino]butanoyl]amino]-3-phenyl-thiourea CAS Name: 1-[[4-[[anilino(sulfanylidene)methyl]hydrazo]-1,4-dioxobutyl]amino]-3-phenylthiourea IUPAC Name: 1-[[4-oxo-4-[2-(phenylcarbamothioyl)hydrazinyl]butanoyl]amino]-3-phenylthiourea Traditional Name: 1-[[4-keto-4-[N'-(phenylthiocarbamoyl)hydrazino]butanoyl]amino]-3-phenyl-thiourea Formula: C18H20N6O2S2 MolecularWeight: 416.5204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=O)CCC(=O)NNC(=S)NC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=O)CCC(=O)NNC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C18H20N6O2S2/c25-15(21-23-17(27)19-13-7-3-1-4-8-13)11-12-16(26)22-24-18(28)20-14-9-5-2-6-10-14/h1-10H,11-12H2,(H,21,25)(H,22,26)(H2,19,23,27)(H2,20,24,28)