6-methyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-1H-indole-2-carboxamide

Systemtic Name: 6-methyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-1H-indole-2-carboxamide Openeye Name: 6-methyl-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-1H-indole-2-carboxamide CAS Name: 6-methyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-1H-indole-2-carboxamide IUPAC Name: 6-methyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-1H-indole-2-carboxamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]-6-methyl-1H-indole-2-carboxamide Formula: C19H20N4O5S MolecularWeight: 416.4509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(N2)C(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(N2)C(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O5S/c1-12-3-4-13-10-17(22-16(13)9-12)19(24)21-8-7-20-15-6-5-14(29(2,27)28)11-18(15)23(25)26/h3-6,9-11,20,22H,7-8H2,1-2H3,(H,21,24)