3-chloranyl-N-[2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 3-chloranyl-N-[2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Openeye Name: 3-chloro-N-[2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide CAS Name: 3-chloro-N-[2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 3-chloro-N-[2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Traditional Name: 3-chloro-N-[2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]benzamide Formula: C25H20ClN3O2S2 MolecularWeight: 494.0282

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=O)CSC3=NC4=C(S3)C=C(C=C4)NC(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)CSC3=NC4=C(S3)C=C(C=C4)NC(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H20ClN3O2S2/c26-18-8-3-6-17(13-18)24(31)27-19-10-11-20-22(14-19)33-25(28-20)32-15-23(30)29-12-4-7-16-5-1-2-9-21(16)29/h1-3,5-6,8-11,13-14H,4,7,12,15H2,(H,27,31)