6-[4-(thiophen-3-ylmethyl)piperazin-1-yl]sulfonyl-3,4-dihydro-1H-quinolin-2-one

Systemtic Name: 6-[4-(thiophen-3-ylmethyl)piperazin-1-yl]sulfonyl-3,4-dihydro-1H-quinolin-2-one Openeye Name: 6-[4-(3-thienylmethyl)piperazin-1-yl]sulfonyl-3,4-dihydro-1H-quinolin-2-one CAS Name: 6-[[4-(3-thiophenylmethyl)-1-piperazinyl]sulfonyl]-3,4-dihydro-1H-quinolin-2-one IUPAC Name: 6-[4-(thiophen-3-ylmethyl)piperazin-1-yl]sulfonyl-3,4-dihydro-1H-quinolin-2-one Traditional Name: 6-[4-(3-thenyl)piperazino]sulfonyl-3,4-dihydrocarbostyril Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

C1CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C18H21N3O3S2/c22-18-4-1-15-11-16(2-3-17(15)19-18)26(23,24)21-8-6-20(7-9-21)12-14-5-10-25-13-14/h2-3,5,10-11,13H,1,4,6-9,12H2,(H,19,22)