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

Systemtic Name: 1-[5-[(4-chlorophenyl)amino]-1,2,4-thiadiazol-3-yl]prop-1-en-2-yl-phenethyl-azanium Openeye Name: [2-[5-(4-chloroanilino)-1,2,4-thiadiazol-3-yl]-1-methyl-vinyl]-phenethyl-ammonium CAS Name: 1-[5-(4-chloroanilino)-1,2,4-thiadiazol-3-yl]prop-1-en-2-yl-phenethylammonium IUPAC Name: 1-[5-(4-chloroanilino)-1,2,4-thiadiazol-3-yl]prop-1-en-2-yl-phenethylazanium Traditional Name: [2-[5-(4-chloroanilino)-1,2,4-thiadiazol-3-yl]-1-methyl-vinyl]-phenethyl-ammonium Formula: C19H20ClN4S+ MolecularWeight: 371.9069

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=NSC(=N1)NC2=CC=C(C=C2)Cl)[NH2+]CCC3=CC=CC=C3

Isomeric SMILES

CC(=CC1=NSC(=N1)NC2=CC=C(C=C2)Cl)[NH2+]CCC3=CC=CC=C3

InChI

InChI=1S/C19H19ClN4S/c1-14(21-12-11-15-5-3-2-4-6-15)13-18-23-19(25-24-18)22-17-9-7-16(20)8-10-17/h2-10,13,21H,11-12H2,1H3,(H,22,23,24)/p+1