N-(2-acetamidoethyl)-5-[(4-tert-butylphenyl)sulfonylamino]-3-pyridin-4-yl-1H-indole-2-carboxamide

Systemtic Name: N-(2-acetamidoethyl)-5-[(4-tert-butylphenyl)sulfonylamino]-3-pyridin-4-yl-1H-indole-2-carboxamide Openeye Name: N-(2-acetamidoethyl)-5-[(4-tert-butylphenyl)sulfonylamino]-3-(4-pyridyl)-1H-indole-2-carboxamide CAS Name: N-(2-acetamidoethyl)-5-[(4-tert-butylphenyl)sulfonylamino]-3-pyridin-4-yl-1H-indole-2-carboxamide IUPAC Name: N-(2-acetamidoethyl)-5-[(4-tert-butylphenyl)sulfonylamino]-3-pyridin-4-yl-1H-indole-2-carboxamide Traditional Name: N-(2-acetamidoethyl)-5-[(4-tert-butylphenyl)sulfonylamino]-3-(4-pyridyl)-1H-indole-2-carboxamide Formula: C28H31N5O4S MolecularWeight: 533.64184

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1=C(C2=C(N1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C4=CC=NC=C4

Isomeric SMILES

CC(=O)NCCNC(=O)C1=C(C2=C(N1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C4=CC=NC=C4

InChI

InChI=1S/C28H31N5O4S/c1-18(34)30-15-16-31-27(35)26-25(19-11-13-29-14-12-19)23-17-21(7-10-24(23)32-26)33-38(36,37)22-8-5-20(6-9-22)28(2,3)4/h5-14,17,32-33H,15-16H2,1-4H3,(H,30,34)(H,31,35)