4-[3-[4-(3-methoxyphenyl)piperazin-1-yl]carbonylpiperidin-1-yl]-2-(1-thiophen-2-ylethyl)isoindole-1,3-dione

Systemtic Name: 4-[3-[4-(3-methoxyphenyl)piperazin-1-yl]carbonylpiperidin-1-yl]-2-(1-thiophen-2-ylethyl)isoindole-1,3-dione Openeye Name: 4-[3-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1-piperidyl]-2-[1-(2-thienyl)ethyl]isoindoline-1,3-dione CAS Name: 4-[3-[[4-(3-methoxyphenyl)-1-piperazinyl]-oxomethyl]-1-piperidinyl]-2-(1-thiophen-2-ylethyl)isoindole-1,3-dione IUPAC Name: 4-[3-[4-(3-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl]-2-(1-thiophen-2-ylethyl)isoindole-1,3-dione Traditional Name: 4-[3-[4-(3-methoxyphenyl)piperazine-1-carbonyl]piperidino]-2-[1-(2-thienyl)ethyl]isoindoline-1,3-quinone Formula: C31H34N4O4S MolecularWeight: 558.69106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)N2C(=O)C3=C(C2=O)C(=CC=C3)N4CCCC(C4)C(=O)N5CCN(CC5)C6=CC(=CC=C6)OC

Isomeric SMILES

CC(C1=CC=CS1)N2C(=O)C3=C(C2=O)C(=CC=C3)N4CCCC(C4)C(=O)N5CCN(CC5)C6=CC(=CC=C6)OC

InChI

InChI=1S/C31H34N4O4S/c1-21(27-12-6-18-40-27)35-30(37)25-10-4-11-26(28(25)31(35)38)34-13-5-7-22(20-34)29(36)33-16-14-32(15-17-33)23-8-3-9-24(19-23)39-2/h3-4,6,8-12,18-19,21-22H,5,7,13-17,20H2,1-2H3