1-(4-methylphenyl)-3-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiourea

Systemtic Name: 1-(4-methylphenyl)-3-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiourea Openeye Name: 1-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]-3-(p-tolyl)thiourea CAS Name: 1-(4-methylphenyl)-3-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]thiourea IUPAC Name: 1-(4-methylphenyl)-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea Traditional Name: 1-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]-3-(p-tolyl)thiourea Formula: C17H17N7OS MolecularWeight: 367.42818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NNC(=O)CN2N=C(N=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NNC(=O)CN2N=C(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H17N7OS/c1-12-7-9-14(10-8-12)18-17(26)21-19-15(25)11-24-22-16(20-23-24)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,19,25)(H2,18,21,26)