N-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[5-[(7-chloro-4-quinolyl)sulfanyl]-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[5-[(7-chloro-4-quinolinyl)thio]-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[5-(7-chloroquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[5-[(7-chloro-4-quinolyl)thio]-1,3,4-thiadiazol-2-yl]-piperonylamide Formula: C19H11ClN4O3S2 MolecularWeight: 442.89864

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NN=C(S3)SC4=C5C=CC(=CC5=NC=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NN=C(S3)SC4=C5C=CC(=CC5=NC=C4)Cl

InChI

InChI=1S/C19H11ClN4O3S2/c20-11-2-3-12-13(8-11)21-6-5-16(12)28-19-24-23-18(29-19)22-17(25)10-1-4-14-15(7-10)27-9-26-14/h1-8H,9H2,(H,22,23,25)