1-[5-[(3,4-dichlorophenyl)amino]-1,2,4-thiadiazol-3-yl]prop-1-en-2-yl-propyl-azanium

Systemtic Name: 1-[5-[(3,4-dichlorophenyl)amino]-1,2,4-thiadiazol-3-yl]prop-1-en-2-yl-propyl-azanium Openeye Name: [2-[5-(3,4-dichloroanilino)-1,2,4-thiadiazol-3-yl]-1-methyl-vinyl]-propyl-ammonium CAS Name: 1-[5-(3,4-dichloroanilino)-1,2,4-thiadiazol-3-yl]prop-1-en-2-yl-propylammonium IUPAC Name: 1-[5-(3,4-dichloroanilino)-1,2,4-thiadiazol-3-yl]prop-1-en-2-yl-propylazanium Traditional Name: [2-[5-(3,4-dichloroanilino)-1,2,4-thiadiazol-3-yl]-1-methyl-vinyl]-propyl-ammonium Formula: C14H17Cl2N4S+ MolecularWeight: 344.28258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]C(=CC1=NSC(=N1)NC2=CC(=C(C=C2)Cl)Cl)C

Isomeric SMILES

CCC[NH2+]C(=CC1=NSC(=N1)NC2=CC(=C(C=C2)Cl)Cl)C

InChI

InChI=1S/C14H16Cl2N4S/c1-3-6-17-9(2)7-13-19-14(21-20-13)18-10-4-5-11(15)12(16)8-10/h4-5,7-8,17H,3,6H2,1-2H3,(H,18,19,20)/p+1