(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[2-(2-methylpropanoylamino)ethyl]butanamide

Systemtic Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[2-(2-methylpropanoylamino)ethyl]butanamide Openeye Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[2-(2-methylpropanoylamino)ethyl]butanamide CAS Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]butanamide IUPAC Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[2-(2-methylpropanoylamino)ethyl]butanamide Traditional Name: (2S)-N-[2-(isobutyrylamino)ethyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butyramide Formula: C18H29N3O5S MolecularWeight: 399.50496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCNC(=O)C(C)C)NS(=O)(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCNC(=O)C(C)C)NS(=O)(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C18H29N3O5S/c1-12(2)16(18(23)20-11-10-19-17(22)13(3)4)21-27(24,25)15-8-6-14(26-5)7-9-15/h6-9,12-13,16,21H,10-11H2,1-5H3,(H,19,22)(H,20,23)/t16-/m0/s1