1-[(4-methoxyphenyl)methyl]-2-oxidanylidene-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinoline-3-carbonitrile

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-2-oxidanylidene-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinoline-3-carbonitrile Openeye Name: 1-[(4-methoxyphenyl)methyl]-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]quinoline-3-carbonitrile CAS Name: 1-[(4-methoxyphenyl)methyl]-2-oxo-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-quinolinecarbonitrile IUPAC Name: 1-[(4-methoxyphenyl)methyl]-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]quinoline-3-carbonitrile Traditional Name: 2-keto-1-p-anisyl-4-[4-(2-thenoyl)piperazino]quinoline-3-carbonitrile Formula: C27H24N4O3S MolecularWeight: 484.56946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C(C2=O)C#N)N4CCN(CC4)C(=O)C5=CC=CS5

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C(C2=O)C#N)N4CCN(CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C27H24N4O3S/c1-34-20-10-8-19(9-11-20)18-31-23-6-3-2-5-21(23)25(22(17-28)26(31)32)29-12-14-30(15-13-29)27(33)24-7-4-16-35-24/h2-11,16H,12-15,18H2,1H3