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

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-1-decyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-decyl-2-hydroxy-4-oxo-quinoline-3-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-decyl-2-hydroxy-4-oxo-3-quinolinecarboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-decyl-2-hydroxy-4-oxoquinoline-3-carboxamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-decyl-2-hydroxy-4-keto-quinoline-3-carboxamide Formula: C27H30ClN3O3S MolecularWeight: 512.0634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

CCCCCCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C27H30ClN3O3S/c1-2-3-4-5-6-7-8-11-16-31-21-13-10-9-12-19(21)24(32)23(26(31)34)25(33)30-27-29-20-15-14-18(28)17-22(20)35-27/h9-10,12-15,17,34H,2-8,11,16H2,1H3,(H,29,30,33)