4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[1-(3,4-dimethylphenyl)ethylideneamino]benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[1-(3,4-dimethylphenyl)ethylideneamino]benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[1-(3,4-dimethylphenyl)ethylideneamino]benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[1-(3,4-dimethylphenyl)ethylideneamino]benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[1-(3,4-dimethylphenyl)ethylideneamino]benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[1-(3,4-dimethylphenyl)ethylideneamino]benzamide Formula: C25H23N3OS2 MolecularWeight: 445.59962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3)C)C

InChI

InChI=1S/C25H23N3OS2/c1-16-8-11-21(14-17(16)2)18(3)27-28-24(29)20-12-9-19(10-13-20)15-30-25-26-22-6-4-5-7-23(22)31-25/h4-14H,15H2,1-3H3,(H,28,29)