methyl 2-[2-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]ethanoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]ethanoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-[(3-methoxyphenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-m-anisylpiperazino)acetyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)OC)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)OC)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O4S/c1-19-24(21-9-5-4-6-10-21)25(27(32)34-3)26(35-19)28-23(31)18-30-14-12-29(13-15-30)17-20-8-7-11-22(16-20)33-2/h4-11,16H,12-15,17-18H2,1-3H3,(H,28,31)