1-[1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(2-nitrophenyl)thiourea

Systemtic Name: 1-[1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(2-nitrophenyl)thiourea Openeye Name: 1-[1-(3-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(2-nitrophenyl)thiourea CAS Name: 1-[1-(3-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)ethylamino]-3-(2-nitrophenyl)thiourea IUPAC Name: 1-[1-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(2-nitrophenyl)thiourea Traditional Name: 1-[1-(6-keto-3-methyl-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(2-nitrophenyl)thiourea Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C)NNC(=S)NC2=CC=CC=C2[N+](=O)[O-])C(=O)C=C1

Isomeric SMILES

CC1=CC(=C(C)NNC(=S)NC2=CC=CC=C2[N+](=O)[O-])C(=O)C=C1

InChI

InChI=1S/C16H16N4O3S/c1-10-7-8-15(21)12(9-10)11(2)18-19-16(24)17-13-5-3-4-6-14(13)20(22)23/h3-9,18H,1-2H3,(H2,17,19,24)