1-methyl-3-[[4-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]phenyl]carbonylamino]thiourea

Systemtic Name: 1-methyl-3-[[4-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]phenyl]carbonylamino]thiourea Openeye Name: 1-methyl-3-[[4-[(5-phenyltetrazol-2-yl)methyl]benzoyl]amino]thiourea CAS Name: 1-methyl-3-[[oxo-[4-[(5-phenyl-2-tetrazolyl)methyl]phenyl]methyl]amino]thiourea IUPAC Name: 1-methyl-3-[[4-[(5-phenyltetrazol-2-yl)methyl]benzoyl]amino]thiourea Traditional Name: 1-methyl-3-[[4-[(5-phenyltetrazol-2-yl)methyl]benzoyl]amino]thiourea Formula: C17H17N7OS MolecularWeight: 367.42818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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