N-(1-azanyl-1-oxidanylidene-propan-2-yl)-3-(3,5-dimethylphenyl)sulfonyl-5-nitro-1H-indole-2-carboxamide

Systemtic Name: N-(1-azanyl-1-oxidanylidene-propan-2-yl)-3-(3,5-dimethylphenyl)sulfonyl-5-nitro-1H-indole-2-carboxamide Openeye Name: N-(2-amino-1-methyl-2-oxo-ethyl)-3-(3,5-dimethylphenyl)sulfonyl-5-nitro-1H-indole-2-carboxamide CAS Name: N-(1-amino-1-oxopropan-2-yl)-3-(3,5-dimethylphenyl)sulfonyl-5-nitro-1H-indole-2-carboxamide IUPAC Name: N-(1-amino-1-oxopropan-2-yl)-3-(3,5-dimethylphenyl)sulfonyl-5-nitro-1H-indole-2-carboxamide Traditional Name: N-(2-amino-2-keto-1-methyl-ethyl)-3-(3,5-dimethylphenyl)sulfonyl-5-nitro-1H-indole-2-carboxamide Formula: C20H20N4O6S MolecularWeight: 444.461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)[N+](=O)[O-])C(=O)NC(C)C(=O)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)[N+](=O)[O-])C(=O)NC(C)C(=O)N)C

InChI

InChI=1S/C20H20N4O6S/c1-10-6-11(2)8-14(7-10)31(29,30)18-15-9-13(24(27)28)4-5-16(15)23-17(18)20(26)22-12(3)19(21)25/h4-9,12,23H,1-3H3,(H2,21,25)(H,22,26)