1-[[(Z)-(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[[(Z)-(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[[(Z)-(3-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea CAS Name: 1-[[(Z)-(3-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[[(Z)-(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea Traditional Name: 1-benzyl-3-[[(Z)-(4-keto-3-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea Formula: C15H14N4O3S MolecularWeight: 330.36166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NNC=C2C=CC(=O)C(=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NN/C=C\2/C=CC(=O)C(=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O3S/c20-14-7-6-12(8-13(14)19(21)22)10-17-18-15(23)16-9-11-4-2-1-3-5-11/h1-8,10,17H,9H2,(H2,16,18,23)/b12-10-