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

Systemtic Name: methyl 2-[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethanoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-(3,4-dichlorophenyl)-1-piperazinyl]-1-oxoethyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl]amino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[4-(3,4-dichlorophenyl)piperazino]acetyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C25H25Cl2N3O3S MolecularWeight: 518.4553

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25Cl2N3O3S/c1-16-22(17-6-4-3-5-7-17)23(25(32)33-2)24(34-16)28-21(31)15-29-10-12-30(13-11-29)18-8-9-19(26)20(27)14-18/h3-9,14H,10-13,15H2,1-2H3,(H,28,31)