1-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]-4-thiophen-2-yl-butane-1,4-dione

Systemtic Name: 1-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]-4-thiophen-2-yl-butane-1,4-dione Openeye Name: 1-[4-(4-isopropylbenzoyl)piperazin-1-yl]-4-(2-thienyl)butane-1,4-dione CAS Name: 1-[4-[oxo-(4-propan-2-ylphenyl)methyl]-1-piperazinyl]-4-thiophen-2-ylbutane-1,4-dione IUPAC Name: 1-[4-(4-propan-2-ylbenzoyl)piperazin-1-yl]-4-thiophen-2-ylbutane-1,4-dione Traditional Name: 1-(4-cumoylpiperazino)-4-(2-thienyl)butane-1,4-dione Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C22H26N2O3S/c1-16(2)17-5-7-18(8-6-17)22(27)24-13-11-23(12-14-24)21(26)10-9-19(25)20-4-3-15-28-20/h3-8,15-16H,9-14H2,1-2H3