(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]butanamide

Systemtic Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]butanamide Openeye Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[3-(2-oxoazepan-1-yl)propyl]butanamide CAS Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[3-(2-oxo-1-azepanyl)propyl]butanamide IUPAC Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[3-(2-oxoazepan-1-yl)propyl]butanamide Traditional Name: (2S)-N-[3-(2-ketoazepan-1-yl)propyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butyramide Formula: C21H33N3O5S MolecularWeight: 439.56882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCCN1CCCCCC1=O)NS(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCCN1CCCCCC1=O)NS(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H33N3O5S/c1-16(2)20(23-30(27,28)18-11-9-17(29-3)10-12-18)21(26)22-13-7-15-24-14-6-4-5-8-19(24)25/h9-12,16,20,23H,4-8,13-15H2,1-3H3,(H,22,26)/t20-/m0/s1