N-[(2S)-1-[2-(4-methylphenyl)carbonylhydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[2-(4-methylphenyl)carbonylhydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-1-[[(4-methylbenzoyl)amino]carbamoyl]-3-methylsulfanyl-propyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[[(4-methylphenyl)-oxomethyl]hydrazo]-4-(methylthio)-1-oxobutan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[2-(4-methylbenzoyl)hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-3-(methylthio)-1-[(p-toluoylamino)carbamoyl]propyl]-2-furamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC(=O)C(CCSC)NC(=O)C2=CC=CO2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC(=O)[C@H](CCSC)NC(=O)C2=CC=CO2

InChI

InChI=1S/C18H21N3O4S/c1-12-5-7-13(8-6-12)16(22)20-21-17(23)14(9-11-26-2)19-18(24)15-4-3-10-25-15/h3-8,10,14H,9,11H2,1-2H3,(H,19,24)(H,20,22)(H,21,23)/t14-/m0/s1