2-pyrrol-1-yl-N-(3,4,5-trimethoxyphenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-pyrrol-1-yl-N-(3,4,5-trimethoxyphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-pyrrol-1-yl-N-(3,4,5-trimethoxyphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-(1-pyrrolyl)-N-(3,4,5-trimethoxyphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-pyrrol-1-yl-N-(3,4,5-trimethoxyphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-pyrrol-1-yl-N-(3,4,5-trimethoxyphenyl)-1,3-benzothiazole-6-carboxamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

InChI

InChI=1S/C21H19N3O4S/c1-26-16-11-14(12-17(27-2)19(16)28-3)22-20(25)13-6-7-15-18(10-13)29-21(23-15)24-8-4-5-9-24/h4-12H,1-3H3,(H,22,25)