4-[1-(4-methylphenyl)sulfonylindol-3-yl]-N-(pyridin-3-ylmethyl)butanamide

Systemtic Name: 4-[1-(4-methylphenyl)sulfonylindol-3-yl]-N-(pyridin-3-ylmethyl)butanamide Openeye Name: 4-[1-(p-tolylsulfonyl)indol-3-yl]-N-(3-pyridylmethyl)butanamide CAS Name: 4-[1-(4-methylphenyl)sulfonyl-3-indolyl]-N-(3-pyridinylmethyl)butanamide IUPAC Name: 4-[1-(4-methylphenyl)sulfonylindol-3-yl]-N-(pyridin-3-ylmethyl)butanamide Traditional Name: N-(3-pyridylmethyl)-4-(1-tosylindol-3-yl)butyramide Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CCCC(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CCCC(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C25H25N3O3S/c1-19-11-13-22(14-12-19)32(30,31)28-18-21(23-8-2-3-9-24(23)28)7-4-10-25(29)27-17-20-6-5-15-26-16-20/h2-3,5-6,8-9,11-16,18H,4,7,10,17H2,1H3,(H,27,29)