N-[5-azanyl-4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-2H-pyrrol-1-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[5-azanyl-4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-2H-pyrrol-1-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[5-amino-4-[4-(4-chlorophenyl)thiazol-2-yl]-3-oxo-2H-pyrrol-1-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[5-amino-4-[4-(4-chlorophenyl)-2-thiazolyl]-3-oxo-2H-pyrrol-1-yl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[5-amino-4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-oxo-2H-pyrrol-1-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-amino-3-[4-(4-chlorophenyl)thiazol-2-yl]-4-keto-2-pyrrolin-1-yl]-piperonylamide Formula: C21H15ClN4O4S MolecularWeight: 454.8862

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(N1NC(=O)C2=CC3=C(C=C2)OCO3)N)C4=NC(=CS4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1C(=O)C(=C(N1NC(=O)C2=CC3=C(C=C2)OCO3)N)C4=NC(=CS4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C21H15ClN4O4S/c22-13-4-1-11(2-5-13)14-9-31-21(24-14)18-15(27)8-26(19(18)23)25-20(28)12-3-6-16-17(7-12)30-10-29-16/h1-7,9H,8,10,23H2,(H,25,28)