2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]phenyl]-N-(thiophen-2-ylmethyl)pyrimidine-5-carboxamide

Systemtic Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]phenyl]-N-(thiophen-2-ylmethyl)pyrimidine-5-carboxamide Openeye Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]phenyl]-N-(2-thienylmethyl)pyrimidine-5-carboxamide CAS Name: 2-[3-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-oxomethyl]phenyl]-N-(thiophen-2-ylmethyl)-5-pyrimidinecarboxamide IUPAC Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylcarbamoyl]phenyl]-N-(thiophen-2-ylmethyl)pyrimidine-5-carboxamide Traditional Name: 2-[3-[homoveratryl(methyl)carbamoyl]phenyl]-N-(2-thenyl)pyrimidine-5-carboxamide Formula: C28H28N4O4S MolecularWeight: 516.61132

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2=CC=CC(=C2)C3=NC=C(C=N3)C(=O)NCC4=CC=CS4

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2=CC=CC(=C2)C3=NC=C(C=N3)C(=O)NCC4=CC=CS4

InChI

InChI=1S/C28H28N4O4S/c1-32(12-11-19-9-10-24(35-2)25(14-19)36-3)28(34)21-7-4-6-20(15-21)26-29-16-22(17-30-26)27(33)31-18-23-8-5-13-37-23/h4-10,13-17H,11-12,18H2,1-3H3,(H,31,33)