1-(2,4-dimethylphenyl)-3-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]thiourea

Systemtic Name: 1-(2,4-dimethylphenyl)-3-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]thiourea Openeye Name: 1-(2,4-dimethylphenyl)-3-[(5-nitro-2-oxo-indol-3-yl)amino]thiourea CAS Name: 1-(2,4-dimethylphenyl)-3-[(5-nitro-2-oxo-3-indolyl)amino]thiourea IUPAC Name: 1-(2,4-dimethylphenyl)-3-[(5-nitro-2-oxoindol-3-yl)amino]thiourea Traditional Name: 1-(2,4-dimethylphenyl)-3-[(2-keto-5-nitro-indol-3-yl)amino]thiourea Formula: C17H15N5O3S MolecularWeight: 369.3977

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NNC2=C3C=C(C=CC3=NC2=O)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NNC2=C3C=C(C=CC3=NC2=O)[N+](=O)[O-])C

InChI

InChI=1S/C17H15N5O3S/c1-9-3-5-13(10(2)7-9)19-17(26)21-20-15-12-8-11(22(24)25)4-6-14(12)18-16(15)23/h3-8H,1-2H3,(H,18,20,23)(H2,19,21,26)