N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-6,8-dimethyl-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-6,8-dimethyl-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-6,8-dimethyl-2-(5-methyl-2-thienyl)quinoline-4-carboxamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-6,8-dimethyl-2-(5-methyl-2-thiophenyl)-4-quinolinecarboxamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-6,8-dimethyl-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-6,8-dimethyl-2-(5-methyl-2-thienyl)cinchoninamide Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)NC4CCS(=O)(=O)C4)C)C

Isomeric SMILES

CC1=CC=C(S1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)N[C@H]4CCS(=O)(=O)C4)C)C

InChI

InChI=1S/C21H22N2O3S2/c1-12-8-13(2)20-16(9-12)17(10-18(23-20)19-5-4-14(3)27-19)21(24)22-15-6-7-28(25,26)11-15/h4-5,8-10,15H,6-7,11H2,1-3H3,(H,22,24)/t15-/m0/s1