N-cyclopentyl-3,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: N-cyclopentyl-3,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: N-cyclopentyl-3,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: N-cyclopentyl-3,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: N-cyclopentyl-3,5-diphenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: N-cyclopentyl-3,5-diphenyl-2-pyrazoline-1-carbothioamide Formula: C21H23N3S MolecularWeight: 349.49242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)N2C(CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)NC(=S)N2C(CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3S/c25-21(22-18-13-7-8-14-18)24-20(17-11-5-2-6-12-17)15-19(23-24)16-9-3-1-4-10-16/h1-6,9-12,18,20H,7-8,13-15H2,(H,22,25)