N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-7-chloranyl-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-7-chloranyl-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(4-acetamidophenyl)thiazol-2-yl]-7-chloro-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-(4-acetamidophenyl)-2-thiazolyl]-7-chloro-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-7-chloro-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(4-acetamidophenyl)thiazol-2-yl]-7-chloro-piperonylamide Formula: C19H14ClN3O4S MolecularWeight: 415.85016

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C19H14ClN3O4S/c1-10(24)21-13-4-2-11(3-5-13)15-8-28-19(22-15)23-18(25)12-6-14(20)17-16(7-12)26-9-27-17/h2-8H,9H2,1H3,(H,21,24)(H,22,23,25)