N-[1-[[1-(3-methoxyphenyl)sulfonyl-3-oxidanylidene-azepan-4-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[1-[[1-(3-methoxyphenyl)sulfonyl-3-oxidanylidene-azepan-4-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]quinoxaline-2-carboxamide Openeye Name: N-[1-[[1-(3-methoxyphenyl)sulfonyl-3-oxo-azepan-4-yl]carbamoyl]-3-methyl-butyl]quinoxaline-2-carboxamide CAS Name: N-[1-[[1-(3-methoxyphenyl)sulfonyl-3-oxo-4-azepanyl]amino]-4-methyl-1-oxopentan-2-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[1-[[1-(3-methoxyphenyl)sulfonyl-3-oxoazepan-4-yl]amino]-4-methyl-1-oxopentan-2-yl]quinoxaline-2-carboxamide Traditional Name: N-[1-[[3-keto-1-(3-methoxyphenyl)sulfonyl-azepan-4-yl]carbamoyl]-3-methyl-butyl]quinoxaline-2-carboxamide Formula: C28H33N5O6S MolecularWeight: 567.65652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1CCCN(CC1=O)S(=O)(=O)C2=CC=CC(=C2)OC)NC(=O)C3=NC4=CC=CC=C4N=C3

Isomeric SMILES

CC(C)CC(C(=O)NC1CCCN(CC1=O)S(=O)(=O)C2=CC=CC(=C2)OC)NC(=O)C3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C28H33N5O6S/c1-18(2)14-24(32-28(36)25-16-29-21-10-4-5-11-22(21)30-25)27(35)31-23-12-7-13-33(17-26(23)34)40(37,38)20-9-6-8-19(15-20)39-3/h4-6,8-11,15-16,18,23-24H,7,12-14,17H2,1-3H3,(H,31,35)(H,32,36)