3-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine

Systemtic Name: 3-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine Openeye Name: 3-[(3-chloro-4-methyl-2-quinolyl)methylsulfanyl]-5-(2-thienyl)-1,2,4-triazol-4-amine CAS Name: 3-[(3-chloro-4-methyl-2-quinolinyl)methylthio]-5-thiophen-2-yl-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-chloro-4-methylquinolin-2-yl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine Traditional Name: [3-[(3-chloro-4-methyl-2-quinolyl)methylthio]-5-(2-thienyl)-1,2,4-triazol-4-yl]amine Formula: C17H14ClN5S2 MolecularWeight: 387.90956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(N3N)C4=CC=CS4)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(N3N)C4=CC=CS4)Cl

InChI

InChI=1S/C17H14ClN5S2/c1-10-11-5-2-3-6-12(11)20-13(15(10)18)9-25-17-22-21-16(23(17)19)14-7-4-8-24-14/h2-8H,9,19H2,1H3