6-(azepan-1-ylsulfonyl)-3-piperidin-1-ylcarbonyl-1-prop-2-enyl-quinolin-4-one

Systemtic Name: 6-(azepan-1-ylsulfonyl)-3-piperidin-1-ylcarbonyl-1-prop-2-enyl-quinolin-4-one Openeye Name: 1-allyl-6-(azepan-1-ylsulfonyl)-3-(piperidine-1-carbonyl)quinolin-4-one CAS Name: 6-(1-azepanylsulfonyl)-3-[oxo(1-piperidinyl)methyl]-1-prop-2-enyl-4-quinolinone IUPAC Name: 6-(azepan-1-ylsulfonyl)-3-(piperidine-1-carbonyl)-1-prop-2-enylquinolin-4-one Traditional Name: 1-allyl-6-(azepan-1-ylsulfonyl)-3-(piperidine-1-carbonyl)-4-quinolone Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3)C(=O)N4CCCCC4

Isomeric SMILES

C=CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3)C(=O)N4CCCCC4

InChI

InChI=1S/C24H31N3O4S/c1-2-12-26-18-21(24(29)25-13-6-5-7-14-25)23(28)20-17-19(10-11-22(20)26)32(30,31)27-15-8-3-4-9-16-27/h2,10-11,17-18H,1,3-9,12-16H2