N-[1-[2-(oxidanylidenemethylidene)-3-(propan-2-ylamino)-4-pyridin-2-yl-piperazin-1-yl]indol-5-yl]-2-pyrrolidin-1-yl-ethanesulfonamide

Systemtic Name: N-[1-[2-(oxidanylidenemethylidene)-3-(propan-2-ylamino)-4-pyridin-2-yl-piperazin-1-yl]indol-5-yl]-2-pyrrolidin-1-yl-ethanesulfonamide Openeye Name: N-[1-[3-(isopropylamino)-2-(oxomethylene)-4-(2-pyridyl)piperazin-1-yl]indol-5-yl]-2-pyrrolidin-1-yl-ethanesulfonamide CAS Name: N-[1-[2-(oxomethylidene)-3-(propan-2-ylamino)-4-(2-pyridinyl)-1-piperazinyl]-5-indolyl]-2-(1-pyrrolidinyl)ethanesulfonamide IUPAC Name: N-[1-[2-(oxomethylidene)-3-(propan-2-ylamino)-4-pyridin-2-ylpiperazin-1-yl]indol-5-yl]-2-pyrrolidin-1-ylethanesulfonamide Traditional Name: N-[1-[3-(isopropylamino)-2-(ketomethylene)-4-(2-pyridyl)piperazino]indol-5-yl]-2-pyrrolidino-ethanesulfonamide Formula: C27H35N7O3S MolecularWeight: 537.6769

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1C(=C=O)N(CCN1C2=CC=CC=N2)N3C=CC4=C3C=CC(=C4)NS(=O)(=O)CCN5CCCC5

Isomeric SMILES

CC(C)NC1C(=C=O)N(CCN1C2=CC=CC=N2)N3C=CC4=C3C=CC(=C4)NS(=O)(=O)CCN5CCCC5

InChI

InChI=1S/C27H35N7O3S/c1-21(2)29-27-25(20-35)34(16-15-32(27)26-7-3-4-11-28-26)33-14-10-22-19-23(8-9-24(22)33)30-38(36,37)18-17-31-12-5-6-13-31/h3-4,7-11,14,19,21,27,29-30H,5-6,12-13,15-18H2,1-2H3