[1-(phenylmethyl)piperidin-4-yl] 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: [1-(phenylmethyl)piperidin-4-yl] 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (1-benzyl-4-piperidyl) 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid [1-(phenylmethyl)-4-piperidinyl] ester IUPAC Name: (1-benzylpiperidin-4-yl) 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (1-benzyl-4-piperidyl) ester Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)OC2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)OC2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H23N3O2S/c1-13-16(11-19-18(24)20-13)17(22)23-15-7-9-21(10-8-15)12-14-5-3-2-4-6-14/h2-6,15H,7-12H2,1H3,(H2,19,20,24)