2-[2-[4-(phenylmethyl)piperazin-1-yl]propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Systemtic Name: 2-[2-[4-(phenylmethyl)piperazin-1-yl]propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Openeye Name: 2-[2-(4-benzylpiperazin-1-yl)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide CAS Name: 2-[[1-oxo-2-[4-(phenylmethyl)-1-piperazinyl]propyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide IUPAC Name: 2-[2-(4-benzylpiperazin-1-yl)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Traditional Name: 2-[2-(4-benzylpiperazino)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C2=C(S1)CCC2)C(=O)N)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=C(C2=C(S1)CCC2)C(=O)N)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H28N4O2S/c1-15(26-12-10-25(11-13-26)14-16-6-3-2-4-7-16)21(28)24-22-19(20(23)27)17-8-5-9-18(17)29-22/h2-4,6-7,15H,5,8-14H2,1H3,(H2,23,27)(H,24,28)