methyl N-[[2-(cyclopentylcarbonylamino)-5-(phenylcarbonyl)phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[2-(cyclopentylcarbonylamino)-5-(phenylcarbonyl)phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[5-benzoyl-2-(cyclopentanecarbonylamino)phenyl]carbamothioyl]carbamate CAS Name: N-[[5-benzoyl-2-[[cyclopentyl(oxo)methyl]amino]anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[5-benzoyl-2-(cyclopentanecarbonylamino)phenyl]carbamothioyl]carbamate Traditional Name: N-[[5-benzoyl-2-(cyclopentanecarbonylamino)phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=S)NC1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)NC(=O)C3CCCC3

Isomeric SMILES

COC(=O)NC(=S)NC1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)NC(=O)C3CCCC3

InChI

InChI=1S/C22H23N3O4S/c1-29-22(28)25-21(30)24-18-13-16(19(26)14-7-3-2-4-8-14)11-12-17(18)23-20(27)15-9-5-6-10-15/h2-4,7-8,11-13,15H,5-6,9-10H2,1H3,(H,23,27)(H2,24,25,28,30)