N-(6-methyl-1,3-benzothiazol-2-yl)-1-(3-methylbutyl)-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-1-(3-methylbutyl)-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 2-hydroxy-1-isopentyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-oxo-quinoline-3-carboxamide CAS Name: 2-hydroxy-N-(6-methyl-1,3-benzothiazol-2-yl)-1-(3-methylbutyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: 2-hydroxy-N-(6-methyl-1,3-benzothiazol-2-yl)-1-(3-methylbutyl)-4-oxoquinoline-3-carboxamide Traditional Name: 2-hydroxy-1-isoamyl-4-keto-N-(6-methyl-1,3-benzothiazol-2-yl)quinoline-3-carboxamide Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(N(C4=CC=CC=C4C3=O)CCC(C)C)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(N(C4=CC=CC=C4C3=O)CCC(C)C)O

InChI

InChI=1S/C23H23N3O3S/c1-13(2)10-11-26-17-7-5-4-6-15(17)20(27)19(22(26)29)21(28)25-23-24-16-9-8-14(3)12-18(16)30-23/h4-9,12-13,29H,10-11H2,1-3H3,(H,24,25,28)