4-[(3S)-1-(5-methylthiophen-2-yl)sulfonylpiperidin-3-yl]carbonyl-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[(3S)-1-(5-methylthiophen-2-yl)sulfonylpiperidin-3-yl]carbonyl-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[(3S)-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carbonyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[[(3S)-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinyl]-oxomethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[(3S)-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carbonyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[(3S)-1-[(5-methyl-2-thienyl)sulfonyl]nipecotoyl]-1,3-dihydroquinoxalin-2-one Formula: C19H21N3O4S2 MolecularWeight: 419.51774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)N3CC(=O)NC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)N3CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C19H21N3O4S2/c1-13-8-9-18(27-13)28(25,26)21-10-4-5-14(11-21)19(24)22-12-17(23)20-15-6-2-3-7-16(15)22/h2-3,6-9,14H,4-5,10-12H2,1H3,(H,20,23)/t14-/m0/s1