N-[(2S)-1-[2-[(3-chlorophenyl)carbamothioyl]hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[2-[(3-chlorophenyl)carbamothioyl]hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-1-[[(3-chlorophenyl)carbamothioylamino]carbamoyl]-2-methyl-propyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[[(3-chloroanilino)-sulfanylidenemethyl]hydrazo]-3-methyl-1-oxobutan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[2-[(3-chlorophenyl)carbamothioyl]hydrazinyl]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-1-[[(3-chlorophenyl)thiocarbamoylamino]carbamoyl]-2-methyl-propyl]-2-furamide Formula: C17H19ClN4O3S MolecularWeight: 394.87576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NNC(=S)NC1=CC(=CC=C1)Cl)NC(=O)C2=CC=CO2

Isomeric SMILES

CC(C)[C@@H](C(=O)NNC(=S)NC1=CC(=CC=C1)Cl)NC(=O)C2=CC=CO2

InChI

InChI=1S/C17H19ClN4O3S/c1-10(2)14(20-15(23)13-7-4-8-25-13)16(24)21-22-17(26)19-12-6-3-5-11(18)9-12/h3-10,14H,1-2H3,(H,20,23)(H,21,24)(H2,19,22,26)/t14-/m0/s1