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

Systemtic Name: methyl 2-[2-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]ethanoylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-[(3-methoxyphenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-m-anisylpiperazino)acetyl]amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4S/c1-15-11-18(21(26)28-3)20(29-15)22-19(25)14-24-9-7-23(8-10-24)13-16-5-4-6-17(12-16)27-2/h4-6,11-12H,7-10,13-14H2,1-3H3,(H,22,25)