N-[2-[2-[(4-butylphenyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]-3-methyl-benzamide

Systemtic Name: N-[2-[2-[(4-butylphenyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]-3-methyl-benzamide Openeye Name: N-[2-[2-[(4-butylphenyl)carbamothioyl]hydrazino]-2-oxo-ethyl]-3-methyl-benzamide CAS Name: N-[2-[[(4-butylanilino)-sulfanylidenemethyl]hydrazo]-2-oxoethyl]-3-methylbenzamide IUPAC Name: N-[2-[2-[(4-butylphenyl)carbamothioyl]hydrazinyl]-2-oxoethyl]-3-methylbenzamide Traditional Name: N-[2-[N'-[(4-butylphenyl)thiocarbamoyl]hydrazino]-2-keto-ethyl]-3-methyl-benzamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CNC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CNC(=O)C2=CC(=CC=C2)C

InChI

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