N-[3-(1-butan-2-yl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[3-(1-butan-2-yl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]-3-methylsulfonyl-benzamide Openeye Name: 3-methylsulfonyl-N-[3-(1-sec-butyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]benzamide CAS Name: N-[3-(1-butan-2-yl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]-3-methylsulfonylbenzamide IUPAC Name: N-[3-(1-butan-2-yl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]-3-methylsulfonylbenzamide Traditional Name: 3-mesyl-N-[3-(1-sec-butyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]benzamide Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCC(=CC1)C2=CNC3=C2C=C(C=C3)NC(=O)C4=CC(=CC=C4)S(=O)(=O)C

Isomeric SMILES

CCC(C)N1CCC(=CC1)C2=CNC3=C2C=C(C=C3)NC(=O)C4=CC(=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C25H29N3O3S/c1-4-17(2)28-12-10-18(11-13-28)23-16-26-24-9-8-20(15-22(23)24)27-25(29)19-6-5-7-21(14-19)32(3,30)31/h5-10,14-17,26H,4,11-13H2,1-3H3,(H,27,29)