(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(pyridin-3-ylmethyl)butanamide

Systemtic Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(pyridin-3-ylmethyl)butanamide Openeye Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(3-pyridylmethyl)butanamide CAS Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(3-pyridinylmethyl)butanamide IUPAC Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(pyridin-3-ylmethyl)butanamide Traditional Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(3-pyridylmethyl)butyramide Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CN=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CN=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H23N3O4S/c1-13(2)17(18(22)20-12-14-5-4-10-19-11-14)21-26(23,24)16-8-6-15(25-3)7-9-16/h4-11,13,17,21H,12H2,1-3H3,(H,20,22)/t17-/m0/s1