(2S)-2-[2-[(4-acetamidophenyl)sulfonyl-methyl-amino]ethanoylamino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[2-[(4-acetamidophenyl)sulfonyl-methyl-amino]ethanoylamino]-N-propyl-propanamide Openeye Name: (2S)-2-[[2-[(4-acetamidophenyl)sulfonyl-methyl-amino]acetyl]amino]-N-propyl-propanamide CAS Name: (2S)-2-[[2-[(4-acetamidophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[[2-[(4-acetamidophenyl)sulfonyl-methylamino]acetyl]amino]-N-propylpropanamide Traditional Name: (2S)-2-[[2-[(4-acetamidophenyl)sulfonyl-methyl-amino]acetyl]amino]-N-propyl-propionamide Formula: C17H26N4O5S MolecularWeight: 398.47714

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C

InChI

InChI=1S/C17H26N4O5S/c1-5-10-18-17(24)12(2)19-16(23)11-21(4)27(25,26)15-8-6-14(7-9-15)20-13(3)22/h6-9,12H,5,10-11H2,1-4H3,(H,18,24)(H,19,23)(H,20,22)/t12-/m0/s1