3-phenylpropyl 4-(3-chlorophenyl)-6-(2-piperidin-1-ylethoxymethyl)-2-thiophen-2-yl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: 3-phenylpropyl 4-(3-chlorophenyl)-6-(2-piperidin-1-ylethoxymethyl)-2-thiophen-2-yl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: 3-phenylpropyl 4-(3-chlorophenyl)-6-[2-(1-piperidyl)ethoxymethyl]-2-(2-thienyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(3-chlorophenyl)-6-[2-(1-piperidinyl)ethoxymethyl]-2-thiophen-2-yl-1,4-dihydropyrimidine-5-carboxylic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-(3-chlorophenyl)-6-(2-piperidin-1-ylethoxymethyl)-2-thiophen-2-yl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(3-chlorophenyl)-6-(2-piperidinoethoxymethyl)-2-(2-thienyl)-1,4-dihydropyrimidine-5-carboxylic acid 3-phenylpropyl ester Formula: C32H36ClN3O3S MolecularWeight: 578.16454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOCC2=C(C(N=C(N2)C3=CC=CS3)C4=CC(=CC=C4)Cl)C(=O)OCCCC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)CCOCC2=C(C(N=C(N2)C3=CC=CS3)C4=CC(=CC=C4)Cl)C(=O)OCCCC5=CC=CC=C5

InChI

InChI=1S/C32H36ClN3O3S/c33-26-14-7-13-25(22-26)30-29(32(37)39-19-8-12-24-10-3-1-4-11-24)27(34-31(35-30)28-15-9-21-40-28)23-38-20-18-36-16-5-2-6-17-36/h1,3-4,7,9-11,13-15,21-22,30H,2,5-6,8,12,16-20,23H2,(H,34,35)