N-(1,3-benzothiazol-2-ylmethyl)-2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(3,4-dimethoxyphenyl)thiazole-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(3,4-dimethoxyphenyl)-4-thiazolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(3,4-dimethoxyphenyl)thiazole-4-carboxamide Formula: C20H17N3O3S2 MolecularWeight: 411.49728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)NCC3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)NCC3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C20H17N3O3S2/c1-25-15-8-7-12(9-16(15)26-2)20-23-14(11-27-20)19(24)21-10-18-22-13-5-3-4-6-17(13)28-18/h3-9,11H,10H2,1-2H3,(H,21,24)