N-(2,2-dimethoxyethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2,2-dimethoxyethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2,2-dimethoxyethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-(2,2-dimethoxyethyl)-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2,2-dimethoxyethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2,2-dimethoxyethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C16H17N3O3S MolecularWeight: 331.38948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(CNC(=O)C1=CC2=C(C=C1)N=C(S2)N3C=CC=C3)OC

Isomeric SMILES

COC(CNC(=O)C1=CC2=C(C=C1)N=C(S2)N3C=CC=C3)OC

InChI

InChI=1S/C16H17N3O3S/c1-21-14(22-2)10-17-15(20)11-5-6-12-13(9-11)23-16(18-12)19-7-3-4-8-19/h3-9,14H,10H2,1-2H3,(H,17,20)