3-[2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]ethanoylamino]-5-phenyl-thiophene-2-carboxamide

Systemtic Name: 3-[2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]ethanoylamino]-5-phenyl-thiophene-2-carboxamide Openeye Name: 3-[[2-[4-(4-methylbenzoyl)piperazin-1-yl]acetyl]amino]-5-phenyl-thiophene-2-carboxamide CAS Name: 3-[[2-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxamide IUPAC Name: 3-[[2-[4-(4-methylbenzoyl)piperazin-1-yl]acetyl]amino]-5-phenylthiophene-2-carboxamide Traditional Name: 5-phenyl-3-[[2-(4-p-toluoylpiperazino)acetyl]amino]thiophene-2-carboxamide Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(=O)NC3=C(SC(=C3)C4=CC=CC=C4)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(=O)NC3=C(SC(=C3)C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C25H26N4O3S/c1-17-7-9-19(10-8-17)25(32)29-13-11-28(12-14-29)16-22(30)27-20-15-21(33-23(20)24(26)31)18-5-3-2-4-6-18/h2-10,15H,11-14,16H2,1H3,(H2,26,31)(H,27,30)