tert-butyl 4-[[2-[[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]carbamoyl]-1-methyl-indol-7-yl]methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-[[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]carbamoyl]-1-methyl-indol-7-yl]methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[[2-[[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]carbamoyl]-1-methyl-indol-7-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[2-[[5-tert-butyl-3-(methanesulfonamido)-2-methoxyanilino]-oxomethyl]-1-methyl-7-indolyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-[[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]carbamoyl]-1-methylindol-7-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[2-[[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]carbamoyl]-1-methyl-indol-7-yl]methyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C32H45N5O6S MolecularWeight: 627.7946

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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)CN4CCN(CC4)C(=O)OC(C)(C)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)CN4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C32H45N5O6S/c1-31(2,3)23-18-24(28(42-8)25(19-23)34-44(9,40)41)33-29(38)26-17-21-11-10-12-22(27(21)35(26)7)20-36-13-15-37(16-14-36)30(39)43-32(4,5)6/h10-12,17-19,34H,13-16,20H2,1-9H3,(H,33,38)