methyl 2-[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[4-(1-naphthylmethyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[4-(1-naphthalenylmethyl)-1-piperazinyl]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-[4-(1-naphthylmethyl)piperazino]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1)NC(=O)CN2CCN(CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC(=O)C1=C(SC=C1)NC(=O)CN2CCN(CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H25N3O3S/c1-29-23(28)20-9-14-30-22(20)24-21(27)16-26-12-10-25(11-13-26)15-18-7-4-6-17-5-2-3-8-19(17)18/h2-9,14H,10-13,15-16H2,1H3,(H,24,27)