N-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-7-[[6-(cyclopropylamino)pyridin-3-yl]carbonylamino]-1-methyl-indole-2-carboxamide

Systemtic Name: N-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-7-[[6-(cyclopropylamino)pyridin-3-yl]carbonylamino]-1-methyl-indole-2-carboxamide Openeye Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-7-[[6-(cyclopropylamino)pyridine-3-carbonyl]amino]-1-methyl-indole-2-carboxamide CAS Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-7-[[[6-(cyclopropylamino)-3-pyridinyl]-oxomethyl]amino]-1-methyl-2-indolecarboxamide IUPAC Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-7-[[6-(cyclopropylamino)pyridine-3-carbonyl]amino]-1-methylindole-2-carboxamide Traditional Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-7-[[6-(cyclopropylamino)nicotinoyl]amino]-1-methyl-indole-2-carboxamide Formula: C31H36N6O5S MolecularWeight: 604.71974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)NS(=O)(=O)C)OC)NC(=O)C2=CC3=C(N2C)C(=CC=C3)NC(=O)C4=CN=C(C=C4)NC5CC5

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)NS(=O)(=O)C)OC)NC(=O)C2=CC3=C(N2C)C(=CC=C3)NC(=O)C4=CN=C(C=C4)NC5CC5

InChI

InChI=1S/C31H36N6O5S/c1-31(2,3)20-15-23(28(42-5)24(16-20)36-43(6,40)41)35-30(39)25-14-18-8-7-9-22(27(18)37(25)4)34-29(38)19-10-13-26(32-17-19)33-21-11-12-21/h7-10,13-17,21,36H,11-12H2,1-6H3,(H,32,33)(H,34,38)(H,35,39)