methyl 5-methyl-3-[[4-(2-methylpropyl)phenyl]sulfonylamino]-1H-indole-2-carboxylate

Systemtic Name: methyl 5-methyl-3-[[4-(2-methylpropyl)phenyl]sulfonylamino]-1H-indole-2-carboxylate Openeye Name: methyl 3-[(4-isobutylphenyl)sulfonylamino]-5-methyl-1H-indole-2-carboxylate CAS Name: 5-methyl-3-[[4-(2-methylpropyl)phenyl]sulfonylamino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-methyl-3-[[4-(2-methylpropyl)phenyl]sulfonylamino]-1H-indole-2-carboxylate Traditional Name: 3-[(4-isobutylphenyl)sulfonylamino]-5-methyl-1H-indole-2-carboxylic acid methyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2NS(=O)(=O)C3=CC=C(C=C3)CC(C)C)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2NS(=O)(=O)C3=CC=C(C=C3)CC(C)C)C(=O)OC

InChI

InChI=1S/C21H24N2O4S/c1-13(2)11-15-6-8-16(9-7-15)28(25,26)23-19-17-12-14(3)5-10-18(17)22-20(19)21(24)27-4/h5-10,12-13,22-23H,11H2,1-4H3