(2S)-2-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]-N-propyl-propanamide Openeye Name: (2S)-2-[[2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanylacetyl]amino]-N-propyl-propanamide CAS Name: (2S)-2-[[2-[[2-(3-methylanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[[2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetyl]amino]-N-propylpropanamide Traditional Name: (2S)-2-[[2-[[2-keto-2-(m-toluidino)ethyl]thio]acetyl]amino]-N-propyl-propionamide Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)CSCC(=O)NC1=CC=CC(=C1)C

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)CSCC(=O)NC1=CC=CC(=C1)C

InChI

InChI=1S/C17H25N3O3S/c1-4-8-18-17(23)13(3)19-15(21)10-24-11-16(22)20-14-7-5-6-12(2)9-14/h5-7,9,13H,4,8,10-11H2,1-3H3,(H,18,23)(H,19,21)(H,20,22)/t13-/m0/s1