N-[[5-cyclopropyl-4-[(3,4-dichlorophenyl)hydrazinylidene]pyrazol-3-yl]carbamothioyl]benzamide

Systemtic Name: N-[[5-cyclopropyl-4-[(3,4-dichlorophenyl)hydrazinylidene]pyrazol-3-yl]carbamothioyl]benzamide Openeye Name: N-[[5-cyclopropyl-4-[(3,4-dichlorophenyl)hydrazono]pyrazol-3-yl]carbamothioyl]benzamide CAS Name: N-[[[5-cyclopropyl-4-[(3,4-dichlorophenyl)hydrazinylidene]-3-pyrazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[5-cyclopropyl-4-[(3,4-dichlorophenyl)hydrazinylidene]pyrazol-3-yl]carbamothioyl]benzamide Traditional Name: N-[[5-cyclopropyl-4-[(3,4-dichlorophenyl)hydrazono]pyrazol-3-yl]thiocarbamoyl]benzamide Formula: C20H16Cl2N6OS MolecularWeight: 459.35164

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(C2=NNC3=CC(=C(C=C3)Cl)Cl)NC(=S)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC1C2=NN=C(C2=NNC3=CC(=C(C=C3)Cl)Cl)NC(=S)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H16Cl2N6OS/c21-14-9-8-13(10-15(14)22)25-27-17-16(11-6-7-11)26-28-18(17)23-20(30)24-19(29)12-4-2-1-3-5-12/h1-5,8-11,25H,6-7H2,(H2,23,24,27,28,29,30)