1-[[5-oxidanylidene-5-[2-(phenylcarbamothioyl)hydrazinyl]pentanoyl]amino]-3-phenyl-thiourea

Systemtic Name: 1-[[5-oxidanylidene-5-[2-(phenylcarbamothioyl)hydrazinyl]pentanoyl]amino]-3-phenyl-thiourea Openeye Name: 1-[[5-oxo-5-[2-(phenylcarbamothioyl)hydrazino]pentanoyl]amino]-3-phenyl-thiourea CAS Name: 1-[[5-[[anilino(sulfanylidene)methyl]hydrazo]-1,5-dioxopentyl]amino]-3-phenylthiourea IUPAC Name: 1-[[5-oxo-5-[2-(phenylcarbamothioyl)hydrazinyl]pentanoyl]amino]-3-phenylthiourea Traditional Name: 1-[[5-keto-5-[N'-(phenylthiocarbamoyl)hydrazino]pentanoyl]amino]-3-phenyl-thiourea Formula: C19H22N6O2S2 MolecularWeight: 430.54698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N6O2S2/c26-16(22-24-18(28)20-14-8-3-1-4-9-14)12-7-13-17(27)23-25-19(29)21-15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2,(H,22,26)(H,23,27)(H2,20,24,28)(H2,21,25,29)