N-(6-chloranyl-1,3-benzothiazol-2-yl)-3-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)propanamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-3-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)propanamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-3-(4,8-dimethyl-2-oxo-1-quinolyl)propanamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-3-(4,8-dimethyl-2-oxo-1-quinolinyl)propanamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-3-(4,8-dimethyl-2-oxoquinolin-1-yl)propanamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-3-(2-keto-4,8-dimethyl-1-quinolyl)propionamide Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C(=O)C=C2C)CCC(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

CC1=CC=CC2=C1N(C(=O)C=C2C)CCC(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C21H18ClN3O2S/c1-12-4-3-5-15-13(2)10-19(27)25(20(12)15)9-8-18(26)24-21-23-16-7-6-14(22)11-17(16)28-21/h3-7,10-11H,8-9H2,1-2H3,(H,23,24,26)