N-[5-[(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: N-[5-[(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-[5-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]propanamide CAS Name: N-[5-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)thio]-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-[5-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: N-[5-[(6-chloro-2-keto-4-phenyl-1H-quinolin-3-yl)thio]-1,3,4-thiadiazol-2-yl]propionamide Formula: C20H15ClN4O2S2 MolecularWeight: 442.9417

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NN=C(S1)SC2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4

Isomeric SMILES

CCC(=O)NC1=NN=C(S1)SC2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4

InChI

InChI=1S/C20H15ClN4O2S2/c1-2-15(26)23-19-24-25-20(29-19)28-17-16(11-6-4-3-5-7-11)13-10-12(21)8-9-14(13)22-18(17)27/h3-10H,2H2,1H3,(H,22,27)(H,23,24,26)