5-[(2-chloranyl-7-methyl-quinolin-3-yl)methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(2-chloranyl-7-methyl-quinolin-3-yl)methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Openeye Name: N-allyl-5-[(2-chloro-7-methyl-3-quinolyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(2-chloro-7-methyl-3-quinolinyl)methylthio]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(2-chloro-7-methylquinolin-3-yl)methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Traditional Name: allyl-[5-[(2-chloro-7-methyl-3-quinolyl)methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C16H15ClN4S2 MolecularWeight: 362.9001

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)CSC3=NN=C(S3)NCC=C)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)CSC3=NN=C(S3)NCC=C)Cl

InChI

InChI=1S/C16H15ClN4S2/c1-3-6-18-15-20-21-16(23-15)22-9-12-8-11-5-4-10(2)7-13(11)19-14(12)17/h3-5,7-8H,1,6,9H2,2H3,(H,18,20)