1-phenyl-N-[[2-(4-phenylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]cyclopentane-1-carboxamide

Systemtic Name: 1-phenyl-N-[[2-(4-phenylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]cyclopentane-1-carboxamide Openeye Name: 1-phenyl-N-[[2-(4-phenylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]cyclopentanecarboxamide CAS Name: 1-phenyl-N-[[[2-(4-phenylphenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-1-cyclopentanecarboxamide IUPAC Name: 1-phenyl-N-[[2-(4-phenylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]cyclopentane-1-carboxamide Traditional Name: 1-phenyl-N-[[2-(4-phenylphenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]cyclopentanecarboxamide Formula: C32H27N3O2S MolecularWeight: 517.64068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=CC=C2)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=N4)C5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(C1)(C2=CC=CC=C2)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=N4)C5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H27N3O2S/c36-30(32(19-7-8-20-32)25-11-5-2-6-12-25)35-31(38)33-26-17-18-28-27(21-26)34-29(37-28)24-15-13-23(14-16-24)22-9-3-1-4-10-22/h1-6,9-18,21H,7-8,19-20H2,(H2,33,35,36,38)