(E)-1-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]-3-thiophen-2-yl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]-3-thiophen-2-yl-prop-2-en-1-one Openeye Name: (E)-1-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]-3-(2-thienyl)prop-2-en-1-one CAS Name: (E)-1-[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]-3-thiophen-2-yl-2-propen-1-one IUPAC Name: (E)-1-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]-3-thiophen-2-ylprop-2-en-1-one Traditional Name: (E)-1-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]-3-(2-thienyl)prop-2-en-1-one Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C(=O)C=CC4=CC=CS4

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C(=O)/C=C/C4=CC=CS4

InChI

InChI=1S/C21H21N3O3S2/c1-16-14-17-4-2-6-19(21(17)22-15-16)29(26,27)24-11-9-23(10-12-24)20(25)8-7-18-5-3-13-28-18/h2-8,13-15H,9-12H2,1H3/b8-7+