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

Systemtic Name: N-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-3-methyl-butanamide Openeye Name: N-[5-[(7-chloro-4-quinolyl)sulfanyl]-1,3,4-thiadiazol-2-yl]-3-methyl-butanamide CAS Name: N-[5-[(7-chloro-4-quinolinyl)thio]-1,3,4-thiadiazol-2-yl]-3-methylbutanamide IUPAC Name: N-[5-(7-chloroquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-3-methylbutanamide Traditional Name: N-[5-[(7-chloro-4-quinolyl)thio]-1,3,4-thiadiazol-2-yl]-3-methyl-butyramide Formula: C16H15ClN4OS2 MolecularWeight: 378.8995

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=NN=C(S1)SC2=C3C=CC(=CC3=NC=C2)Cl

Isomeric SMILES

CC(C)CC(=O)NC1=NN=C(S1)SC2=C3C=CC(=CC3=NC=C2)Cl

InChI

InChI=1S/C16H15ClN4OS2/c1-9(2)7-14(22)19-15-20-21-16(24-15)23-13-5-6-18-12-8-10(17)3-4-11(12)13/h3-6,8-9H,7H2,1-2H3,(H,19,20,22)