N-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C21H16N4O4S MolecularWeight: 420.44114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CNC(=O)C3=CC4=C(C=C3)N=C(S4)N5C=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CNC(=O)C3=CC4=C(C=C3)N=C(S4)N5C=CC=C5

InChI

InChI=1S/C21H16N4O4S/c26-19(23-14-4-6-16-17(10-14)29-12-28-16)11-22-20(27)13-3-5-15-18(9-13)30-21(24-15)25-7-1-2-8-25/h1-10H,11-12H2,(H,22,27)(H,23,26)