N-[2-[2-piperazin-1-yl-3-(propan-2-ylamino)pyridin-4-yl]carbonyl-1H-indol-5-yl]methanesulfonamide

Systemtic Name: N-[2-[2-piperazin-1-yl-3-(propan-2-ylamino)pyridin-4-yl]carbonyl-1H-indol-5-yl]methanesulfonamide Openeye Name: N-[2-[3-(isopropylamino)-2-piperazin-1-yl-pyridine-4-carbonyl]-1H-indol-5-yl]methanesulfonamide CAS Name: N-[2-[oxo-[2-(1-piperazinyl)-3-(propan-2-ylamino)-4-pyridinyl]methyl]-1H-indol-5-yl]methanesulfonamide IUPAC Name: N-[2-[2-piperazin-1-yl-3-(propan-2-ylamino)pyridine-4-carbonyl]-1H-indol-5-yl]methanesulfonamide Traditional Name: N-[2-[3-(isopropylamino)-2-piperazino-isonicotinoyl]-1H-indol-5-yl]methanesulfonamide Formula: C22H28N6O3S MolecularWeight: 456.56112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(C=CN=C1N2CCNCC2)C(=O)C3=CC4=C(N3)C=CC(=C4)NS(=O)(=O)C

Isomeric SMILES

CC(C)NC1=C(C=CN=C1N2CCNCC2)C(=O)C3=CC4=C(N3)C=CC(=C4)NS(=O)(=O)C

InChI

InChI=1S/C22H28N6O3S/c1-14(2)25-20-17(6-7-24-22(20)28-10-8-23-9-11-28)21(29)19-13-15-12-16(27-32(3,30)31)4-5-18(15)26-19/h4-7,12-14,23,25-27H,8-11H2,1-3H3