1-(2,3-dihydro-1H-inden-5-yl)-4-[4-(thiophen-3-ylmethyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-yl)-4-[4-(thiophen-3-ylmethyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-indan-5-yl-4-[4-(3-thienylmethyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-4-[4-(3-thiophenylmethyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-4-[4-(thiophen-3-ylmethyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-indan-5-yl-4-[4-(3-thenyl)piperazino]butane-1,4-dione Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)CCC(=O)N3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)CCC(=O)N3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C22H26N2O2S/c25-21(20-5-4-18-2-1-3-19(18)14-20)6-7-22(26)24-11-9-23(10-12-24)15-17-8-13-27-16-17/h4-5,8,13-14,16H,1-3,6-7,9-12,15H2