N-[4-methyl-1-[(7-methyl-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl)amino]-1-oxidanylidene-pentan-2-yl]quinoline-6-carboxamide

Systemtic Name: N-[4-methyl-1-[(7-methyl-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl)amino]-1-oxidanylidene-pentan-2-yl]quinoline-6-carboxamide Openeye Name: N-[3-methyl-1-[[7-methyl-3-oxo-1-(2-pyridylsulfonyl)azepan-4-yl]carbamoyl]butyl]quinoline-6-carboxamide CAS Name: N-[4-methyl-1-[[7-methyl-3-oxo-1-(2-pyridinylsulfonyl)-4-azepanyl]amino]-1-oxopentan-2-yl]-6-quinolinecarboxamide IUPAC Name: N-[4-methyl-1-[(7-methyl-3-oxo-1-pyridin-2-ylsulfonylazepan-4-yl)amino]-1-oxopentan-2-yl]quinoline-6-carboxamide Traditional Name: N-[1-[[3-keto-7-methyl-1-(2-pyridylsulfonyl)azepan-4-yl]carbamoyl]-3-methyl-butyl]quinoline-6-carboxamide Formula: C28H33N5O5S MolecularWeight: 551.65712

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=O)CN1S(=O)(=O)C2=CC=CC=N2)NC(=O)C(CC(C)C)NC(=O)C3=CC4=C(C=C3)N=CC=C4

Isomeric SMILES

CC1CCC(C(=O)CN1S(=O)(=O)C2=CC=CC=N2)NC(=O)C(CC(C)C)NC(=O)C3=CC4=C(C=C3)N=CC=C4

InChI

InChI=1S/C28H33N5O5S/c1-18(2)15-24(32-27(35)21-10-12-22-20(16-21)7-6-14-29-22)28(36)31-23-11-9-19(3)33(17-25(23)34)39(37,38)26-8-4-5-13-30-26/h4-8,10,12-14,16,18-19,23-24H,9,11,15,17H2,1-3H3,(H,31,36)(H,32,35)