N-(2-azanyl-2-oxidanylidene-ethyl)-2-[(4-methylphenyl)sulfonylamino]-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-2-[(4-methylphenyl)sulfonylamino]-3-(phenylmethylsulfanyl)propanamide Openeye Name: N-(2-amino-2-oxo-ethyl)-3-benzylsulfanyl-2-(p-tolylsulfonylamino)propanamide CAS Name: N-(2-amino-2-oxoethyl)-2-[(4-methylphenyl)sulfonylamino]-3-(phenylmethylthio)propanamide IUPAC Name: N-(2-amino-2-oxoethyl)-3-benzylsulfanyl-2-[(4-methylphenyl)sulfonylamino]propanamide Traditional Name: N-(2-amino-2-keto-ethyl)-3-(benzylthio)-2-(tosylamino)propionamide Formula: C19H23N3O4S2 MolecularWeight: 421.53362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CSCC2=CC=CC=C2)C(=O)NCC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CSCC2=CC=CC=C2)C(=O)NCC(=O)N

InChI

InChI=1S/C19H23N3O4S2/c1-14-7-9-16(10-8-14)28(25,26)22-17(19(24)21-11-18(20)23)13-27-12-15-5-3-2-4-6-15/h2-10,17,22H,11-13H2,1H3,(H2,20,23)(H,21,24)