N-[3-[[(2,3-dimethylphenyl)carbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[[(2,3-dimethylphenyl)carbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[(2,3-dimethylphenyl)carbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[[(2,3-dimethylanilino)-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[(2,3-dimethylphenyl)carbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[(2,3-dimethylphenyl)thiocarbamoylamino]carbamoyl]phenyl]cyclopropanecarboxamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NNC(=O)C2=CC(=CC=C2)NC(=O)C3CC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NNC(=O)C2=CC(=CC=C2)NC(=O)C3CC3)C

InChI

InChI=1S/C20H22N4O2S/c1-12-5-3-8-17(13(12)2)22-20(27)24-23-19(26)15-6-4-7-16(11-15)21-18(25)14-9-10-14/h3-8,11,14H,9-10H2,1-2H3,(H,21,25)(H,23,26)(H2,22,24,27)