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

Systemtic Name: 5-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-N-(oxolan-2-ylmethyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(3-chloro-4-methyl-2-quinolyl)methylsulfanyl]-N-(tetrahydrofuran-2-ylmethyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-chloro-4-methyl-2-quinolinyl)methylthio]-N-(2-oxolanylmethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(3-chloro-4-methylquinolin-2-yl)methylsulfanyl]-N-(oxolan-2-ylmethyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(3-chloro-4-methyl-2-quinolyl)methylthio]-1,3,4-thiadiazol-2-yl]-(tetrahydrofurfuryl)amine Formula: C18H19ClN4OS2 MolecularWeight: 406.95266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(S3)NCC4CCCO4)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(S3)NCC4CCCO4)Cl

InChI

InChI=1S/C18H19ClN4OS2/c1-11-13-6-2-3-7-14(13)21-15(16(11)19)10-25-18-23-22-17(26-18)20-9-12-5-4-8-24-12/h2-3,6-7,12H,4-5,8-10H2,1H3,(H,20,22)