3-methyl-N-[(2S)-1-oxidanylidene-1-[2-[(4-propan-2-ylphenyl)carbamothioyl]hydrazinyl]propan-2-yl]benzamide

Systemtic Name: 3-methyl-N-[(2S)-1-oxidanylidene-1-[2-[(4-propan-2-ylphenyl)carbamothioyl]hydrazinyl]propan-2-yl]benzamide Openeye Name: N-[(1S)-2-[2-[(4-isopropylphenyl)carbamothioyl]hydrazino]-1-methyl-2-oxo-ethyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[(2S)-1-oxo-1-[[(4-propan-2-ylanilino)-sulfanylidenemethyl]hydrazo]propan-2-yl]benzamide IUPAC Name: 3-methyl-N-[(2S)-1-oxo-1-[2-[(4-propan-2-ylphenyl)carbamothioyl]hydrazinyl]propan-2-yl]benzamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-[N'-(p-cumenylthiocarbamoyl)hydrazino]ethyl]-3-methyl-benzamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C)C(=O)NNC(=S)NC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](C)C(=O)NNC(=S)NC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C21H26N4O2S/c1-13(2)16-8-10-18(11-9-16)23-21(28)25-24-19(26)15(4)22-20(27)17-7-5-6-14(3)12-17/h5-13,15H,1-4H3,(H,22,27)(H,24,26)(H2,23,25,28)/t15-/m0/s1