N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-(4-pyrrol-1-ylphenyl)ethanamide

Systemtic Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-(4-pyrrol-1-ylphenyl)ethanamide Openeye Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-(4-pyrrol-1-ylphenyl)acetamide CAS Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-[4-(1-pyrrolyl)phenyl]acetamide IUPAC Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-(4-pyrrol-1-ylphenyl)acetamide Traditional Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-(4-pyrrol-1-ylphenyl)acetamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(S2)NC(=O)CC3=CC=C(C=C3)N4C=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(S2)NC(=O)CC3=CC=C(C=C3)N4C=CC=C4)OC

InChI

InChI=1S/C21H19N3O3S/c1-26-17-12-16-19(13-18(17)27-2)28-21(22-16)23-20(25)11-14-5-7-15(8-6-14)24-9-3-4-10-24/h3-10,12-13H,11H2,1-2H3,(H,22,23,25)