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

Systemtic Name: ethyl 3-[2-[4-(diphenylmethyl)piperazin-1-yl]ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-(4-benzhydrylpiperazin-1-yl)acetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[4-(diphenylmethyl)-1-piperazinyl]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-benzhydrylpiperazin-1-yl)acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-(4-benzhydrylpiperazino)acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C32H33N3O3S MolecularWeight: 539.68772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H33N3O3S/c1-2-38-32(37)31-27(22-28(39-31)24-12-6-3-7-13-24)33-29(36)23-34-18-20-35(21-19-34)30(25-14-8-4-9-15-25)26-16-10-5-11-17-26/h3-17,22,30H,2,18-21,23H2,1H3,(H,33,36)