N-cyclopentyl-3-[4-[2-(cyclopentylcarbamothioyl)-5-phenyl-3,4-dihydropyrazol-3-yl]phenyl]-5-phenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: N-cyclopentyl-3-[4-[2-(cyclopentylcarbamothioyl)-5-phenyl-3,4-dihydropyrazol-3-yl]phenyl]-5-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: N-cyclopentyl-3-[4-[2-(cyclopentylcarbamothioyl)-5-phenyl-3,4-dihydropyrazol-3-yl]phenyl]-5-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: N-cyclopentyl-3-[4-[2-[(cyclopentylamino)-sulfanylidenemethyl]-5-phenyl-3,4-dihydropyrazol-3-yl]phenyl]-5-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: N-cyclopentyl-3-[4-[2-(cyclopentylcarbamothioyl)-5-phenyl-3,4-dihydropyrazol-3-yl]phenyl]-5-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: N-cyclopentyl-5-[4-[2-(cyclopentylthiocarbamoyl)-5-phenyl-2-pyrazolin-3-yl]phenyl]-3-phenyl-2-pyrazoline-1-carbothioamide Formula: C36H40N6S2 MolecularWeight: 620.873

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)N2C(CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)C5CC(=NN5C(=S)NC6CCCC6)C7=CC=CC=C7

Isomeric SMILES

C1CCC(C1)NC(=S)N2C(CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)C5CC(=NN5C(=S)NC6CCCC6)C7=CC=CC=C7

InChI

InChI=1S/C36H40N6S2/c43-35(37-29-15-7-8-16-29)41-33(23-31(39-41)25-11-3-1-4-12-25)27-19-21-28(22-20-27)34-24-32(26-13-5-2-6-14-26)40-42(34)36(44)38-30-17-9-10-18-30/h1-6,11-14,19-22,29-30,33-34H,7-10,15-18,23-24H2,(H,37,43)(H,38,44)