3-(1-ethylsulfonylpiperidin-4-yl)-5-[3-[(2-methylpropylamino)methyl]phenyl]-1H-indole-7-carboxamide

Systemtic Name: 3-(1-ethylsulfonylpiperidin-4-yl)-5-[3-[(2-methylpropylamino)methyl]phenyl]-1H-indole-7-carboxamide Openeye Name: 3-(1-ethylsulfonyl-4-piperidyl)-5-[3-[(isobutylamino)methyl]phenyl]-1H-indole-7-carboxamide CAS Name: 3-(1-ethylsulfonyl-4-piperidinyl)-5-[3-[(2-methylpropylamino)methyl]phenyl]-1H-indole-7-carboxamide IUPAC Name: 3-(1-ethylsulfonylpiperidin-4-yl)-5-[3-[(2-methylpropylamino)methyl]phenyl]-1H-indole-7-carboxamide Traditional Name: 3-(1-esyl-4-piperidyl)-5-[3-[(isobutylamino)methyl]phenyl]-1H-indole-7-carboxamide Formula: C27H36N4O3S MolecularWeight: 496.66474

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C2=CNC3=C(C=C(C=C23)C4=CC(=CC=C4)CNCC(C)C)C(=O)N

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C2=CNC3=C(C=C(C=C23)C4=CC(=CC=C4)CNCC(C)C)C(=O)N

InChI

InChI=1S/C27H36N4O3S/c1-4-35(33,34)31-10-8-20(9-11-31)25-17-30-26-23(25)13-22(14-24(26)27(28)32)21-7-5-6-19(12-21)16-29-15-18(2)3/h5-7,12-14,17-18,20,29-30H,4,8-11,15-16H2,1-3H3,(H2,28,32)