5-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-N-(3-methoxyphenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-N-(3-methoxyphenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(3-chloro-4-methyl-2-quinolyl)methylsulfanyl]-N-(3-methoxyphenyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-chloro-4-methyl-2-quinolinyl)methylthio]-N-(3-methoxyphenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(3-chloro-4-methylquinolin-2-yl)methylsulfanyl]-N-(3-methoxyphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(3-chloro-4-methyl-2-quinolyl)methylthio]-1,3,4-thiadiazol-2-yl]-(3-methoxyphenyl)amine Formula: C20H17ClN4OS2 MolecularWeight: 428.95818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(S3)NC4=CC(=CC=C4)OC)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(S3)NC4=CC(=CC=C4)OC)Cl

InChI

InChI=1S/C20H17ClN4OS2/c1-12-15-8-3-4-9-16(15)23-17(18(12)21)11-27-20-25-24-19(28-20)22-13-6-5-7-14(10-13)26-2/h3-10H,11H2,1-2H3,(H,22,24)