N-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,3-thiazol-2-yl]-N-(3,4-dimethylphenyl)ethanamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,3-thiazol-2-yl]-N-(3,4-dimethylphenyl)ethanamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)thiazol-2-yl]-N-(3,4-dimethylphenyl)acetamide CAS Name: N-[4-[(1,3-benzothiazol-2-ylthio)methyl]-2-thiazolyl]-N-(3,4-dimethylphenyl)acetamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,3-thiazol-2-yl]-N-(3,4-dimethylphenyl)acetamide Traditional Name: N-[4-[(1,3-benzothiazol-2-ylthio)methyl]thiazol-2-yl]-N-(3,4-dimethylphenyl)acetamide Formula: C21H19N3OS3 MolecularWeight: 425.59006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C2=NC(=CS2)CSC3=NC4=CC=CC=C4S3)C(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(C2=NC(=CS2)CSC3=NC4=CC=CC=C4S3)C(=O)C)C

InChI

InChI=1S/C21H19N3OS3/c1-13-8-9-17(10-14(13)2)24(15(3)25)20-22-16(11-26-20)12-27-21-23-18-6-4-5-7-19(18)28-21/h4-11H,12H2,1-3H3