1-[(4-nitrophenyl)methyl]-3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]thiourea

Systemtic Name: 1-[(4-nitrophenyl)methyl]-3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Openeye Name: 1-[(4-nitrophenyl)methyl]-3-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]thiourea CAS Name: 1-[(4-nitrophenyl)methyl]-3-[(4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]thiourea IUPAC Name: 1-[(4-nitrophenyl)methyl]-3-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Traditional Name: 1-[(4-ketocyclohexa-2,5-dien-1-ylidene)methylamino]-3-(4-nitrobenzyl)thiourea Formula: C15H14N4O3S MolecularWeight: 330.36166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=CNNC(=S)NCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)C=CC1=CNNC(=S)NCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

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