1-[[3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazol-5-yl]carbonylamino]-3-phenyl-thiourea

Systemtic Name: 1-[[3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazol-5-yl]carbonylamino]-3-phenyl-thiourea Openeye Name: 1-[[3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazole-5-carbonyl]amino]-3-phenyl-thiourea CAS Name: 1-[[oxo-[3-(4-oxo-1-cyclohexa-2,5-dienylidene)-1,2,4-oxadiazol-5-yl]methyl]amino]-3-phenylthiourea IUPAC Name: 1-[[3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazole-5-carbonyl]amino]-3-phenylthiourea Traditional Name: 1-[[3-(4-ketocyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazole-5-carbonyl]amino]-3-phenyl-thiourea Formula: C16H13N5O3S MolecularWeight: 355.37112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=O)C2=NC(=C3C=CC(=O)C=C3)NO2

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=O)C2=NC(=C3C=CC(=O)C=C3)NO2

InChI

InChI=1S/C16H13N5O3S/c22-12-8-6-10(7-9-12)13-18-15(24-21-13)14(23)19-20-16(25)17-11-4-2-1-3-5-11/h1-9,21H,(H,19,23)(H2,17,20,25)