methyl 3-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-[(4-methylphenyl)methyl]piperazin-1-yl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[4-(p-tolylmethyl)piperazine-1-carbonyl]amino]thiophene-2-carboxylate CAS Name: 3-[[[4-[(4-methylphenyl)methyl]-1-piperazinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-[(4-methylphenyl)methyl]piperazine-1-carbonyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[4-(4-methylbenzyl)piperazine-1-carbonyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2)C(=O)NC3=C(SC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(CC2)C(=O)NC3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C19H23N3O3S/c1-14-3-5-15(6-4-14)13-21-8-10-22(11-9-21)19(24)20-16-7-12-26-17(16)18(23)25-2/h3-7,12H,8-11,13H2,1-2H3,(H,20,24)