[5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl 1-phenylcyclopentane-1-carboxylate

Systemtic Name: [5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl 1-phenylcyclopentane-1-carboxylate Openeye Name: [5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl 1-phenylcyclopentanecarboxylate CAS Name: 1-phenyl-1-cyclopentanecarboxylic acid [5-[(4-methoxyanilino)-oxomethyl]-1,3,4-thiadiazol-2-yl]methyl ester IUPAC Name: [5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl 1-phenylcyclopentane-1-carboxylate Traditional Name: 1-phenylcyclopentanecarboxylic acid [5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl ester Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)COC(=O)C3(CCCC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)COC(=O)C3(CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O4S/c1-29-18-11-9-17(10-12-18)24-20(27)21-26-25-19(31-21)15-30-22(28)23(13-5-6-14-23)16-7-3-2-4-8-16/h2-4,7-12H,5-6,13-15H2,1H3,(H,24,27)