2-(2-methylphenyl)ethyl 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylate

Systemtic Name: 2-(2-methylphenyl)ethyl 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylate Openeye Name: 2-(o-tolyl)ethyl 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylate CAS Name: 4-(4-thieno[2,3-d]pyrimidinyl)-1-piperazinecarboxylic acid 2-(2-methylphenyl)ethyl ester IUPAC Name: 2-(2-methylphenyl)ethyl 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylate Traditional Name: 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylic acid 2-(o-tolyl)ethyl ester Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCOC(=O)N2CCN(CC2)C3=C4C=CSC4=NC=N3

Isomeric SMILES

CC1=CC=CC=C1CCOC(=O)N2CCN(CC2)C3=C4C=CSC4=NC=N3

InChI

InChI=1S/C20H22N4O2S/c1-15-4-2-3-5-16(15)6-12-26-20(25)24-10-8-23(9-11-24)18-17-7-13-27-19(17)22-14-21-18/h2-5,7,13-14H,6,8-12H2,1H3