N-[4-[[(3,4-dimethylphenyl)carbamothioylamino]carbamoyl]phenyl]-2-methyl-cyclopropane-1-carboxamide

Systemtic Name: N-[4-[[(3,4-dimethylphenyl)carbamothioylamino]carbamoyl]phenyl]-2-methyl-cyclopropane-1-carboxamide Openeye Name: N-[4-[[(3,4-dimethylphenyl)carbamothioylamino]carbamoyl]phenyl]-2-methyl-cyclopropanecarboxamide CAS Name: N-[4-[[[(3,4-dimethylanilino)-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-2-methyl-1-cyclopropanecarboxamide IUPAC Name: N-[4-[[(3,4-dimethylphenyl)carbamothioylamino]carbamoyl]phenyl]-2-methylcyclopropane-1-carboxamide Traditional Name: N-[4-[[(3,4-dimethylphenyl)thiocarbamoylamino]carbamoyl]phenyl]-2-methyl-cyclopropanecarboxamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1CC1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C21H24N4O2S/c1-12-4-7-17(10-13(12)2)23-21(28)25-24-19(26)15-5-8-16(9-6-15)22-20(27)18-11-14(18)3/h4-10,14,18H,11H2,1-3H3,(H,22,27)(H,24,26)(H2,23,25,28)