N-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]carbamothioyl]cyclopentanecarboxamide

Systemtic Name: N-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]carbamothioyl]cyclopentanecarboxamide Openeye Name: N-[[4-(4-phenylphenyl)thiazol-2-yl]carbamothioyl]cyclopentanecarboxamide CAS Name: N-[[[4-(4-phenylphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]cyclopentanecarboxamide IUPAC Name: N-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]carbamothioyl]cyclopentanecarboxamide Traditional Name: N-[[4-(4-phenylphenyl)thiazol-2-yl]thiocarbamoyl]cyclopentanecarboxamide Formula: C22H21N3OS2 MolecularWeight: 407.55164

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3OS2/c26-20(18-8-4-5-9-18)24-21(27)25-22-23-19(14-28-22)17-12-10-16(11-13-17)15-6-2-1-3-7-15/h1-3,6-7,10-14,18H,4-5,8-9H2,(H2,23,24,25,26,27)