1-[(E)-(1-methyl-2-oxidanylidene-indol-3-ylidene)amino]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[(E)-(1-methyl-2-oxidanylidene-indol-3-ylidene)amino]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[(E)-(1-methyl-2-oxo-indolin-3-ylidene)amino]-3-(4-nitrophenyl)thiourea CAS Name: 1-[(E)-(1-methyl-2-oxo-3-indolylidene)amino]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[(E)-(1-methyl-2-oxoindol-3-ylidene)amino]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[(E)-(2-keto-1-methyl-indolin-3-ylidene)amino]-3-(4-nitrophenyl)thiourea Formula: C16H13N5O3S MolecularWeight: 355.37112

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-])C1=O

Isomeric SMILES

CN1C2=CC=CC=C2/C(=N\NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-])/C1=O

InChI

InChI=1S/C16H13N5O3S/c1-20-13-5-3-2-4-12(13)14(15(20)22)18-19-16(25)17-10-6-8-11(9-7-10)21(23)24/h2-9H,1H3,(H2,17,19,25)/b18-14+