6-methyl-1-(2-morpholin-4-ylethyl)-2-oxidanylidene-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinoline-3-carbonitrile

Systemtic Name: 6-methyl-1-(2-morpholin-4-ylethyl)-2-oxidanylidene-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinoline-3-carbonitrile Openeye Name: 6-methyl-1-(2-morpholinoethyl)-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]quinoline-3-carbonitrile CAS Name: 6-methyl-1-[2-(4-morpholinyl)ethyl]-2-oxo-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-quinolinecarbonitrile IUPAC Name: 6-methyl-1-(2-morpholin-4-ylethyl)-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]quinoline-3-carbonitrile Traditional Name: 2-keto-6-methyl-1-(2-morpholinoethyl)-4-[4-(2-thenoyl)piperazino]quinoline-3-carbonitrile Formula: C26H29N5O3S MolecularWeight: 491.60516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C(=C2N3CCN(CC3)C(=O)C4=CC=CS4)C#N)CCN5CCOCC5

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C(=C2N3CCN(CC3)C(=O)C4=CC=CS4)C#N)CCN5CCOCC5

InChI

InChI=1S/C26H29N5O3S/c1-19-4-5-22-20(17-19)24(29-7-9-30(10-8-29)26(33)23-3-2-16-35-23)21(18-27)25(32)31(22)11-6-28-12-14-34-15-13-28/h2-5,16-17H,6-15H2,1H3