N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide

Systemtic Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Openeye Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-(thiazol-4-ylmethylsulfanyl)benzamide CAS Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-(4-thiazolylmethylthio)benzamide IUPAC Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Traditional Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-(thiazol-4-ylmethylthio)benzamide Formula: C20H17N3O3S3 MolecularWeight: 443.56228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)SCC4=CSC=N4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)SCC4=CSC=N4)OC

InChI

InChI=1S/C20H17N3O3S3/c1-25-16-7-15-18(8-17(16)26-2)29-20(22-15)23-19(24)12-3-5-14(6-4-12)28-10-13-9-27-11-21-13/h3-9,11H,10H2,1-2H3,(H,22,23,24)