N-[2-[[(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanoyl]amino]ethyl]benzamide

Systemtic Name: N-[2-[[(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanoyl]amino]ethyl]benzamide Openeye Name: N-[2-[[(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanoyl]amino]ethyl]benzamide CAS Name: N-[2-[[(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-1-oxobutyl]amino]ethyl]benzamide IUPAC Name: N-[2-[[(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbutanoyl]amino]ethyl]benzamide Traditional Name: N-[2-[[(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanoyl]amino]ethyl]benzamide Formula: C21H27N3O5S MolecularWeight: 433.52118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCNC(=O)C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O5S/c1-15(2)19(24-30(27,28)18-11-9-17(29-3)10-12-18)21(26)23-14-13-22-20(25)16-7-5-4-6-8-16/h4-12,15,19,24H,13-14H2,1-3H3,(H,22,25)(H,23,26)/t19-/m0/s1