N-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-1-methyl-7-[2-[(4-methylpiperazin-1-yl)methyl]pyridin-4-yl]oxy-indole-2-carboxamide

Systemtic Name: N-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-1-methyl-7-[2-[(4-methylpiperazin-1-yl)methyl]pyridin-4-yl]oxy-indole-2-carboxamide Openeye Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-1-methyl-7-[[2-[(4-methylpiperazin-1-yl)methyl]-4-pyridyl]oxy]indole-2-carboxamide CAS Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-1-methyl-7-[[2-[(4-methyl-1-piperazinyl)methyl]-4-pyridinyl]oxy]-2-indolecarboxamide IUPAC Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-1-methyl-7-[2-[(4-methylpiperazin-1-yl)methyl]pyridin-4-yl]oxyindole-2-carboxamide Traditional Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-1-methyl-7-[[2-[(4-methylpiperazino)methyl]-4-pyridyl]oxy]indole-2-carboxamide Formula: C33H42N6O5S MolecularWeight: 634.78878

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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)OC4=CC(=NC=C4)CN5CCN(CC5)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)NS(=O)(=O)C)OC)NC(=O)C2=CC3=C(N2C)C(=CC=C3)OC4=CC(=NC=C4)CN5CCN(CC5)C

InChI

InChI=1S/C33H42N6O5S/c1-33(2,3)23-18-26(31(43-6)27(19-23)36-45(7,41)42)35-32(40)28-17-22-9-8-10-29(30(22)38(28)5)44-25-11-12-34-24(20-25)21-39-15-13-37(4)14-16-39/h8-12,17-20,36H,13-16,21H2,1-7H3,(H,35,40)