4-azanyl-3-chloranyl-5-[[3-(4-chlorophenyl)sulfinylphenyl]methyl]-4H-1,2,3-triazole-5-carboxamide

Systemtic Name: 4-azanyl-3-chloranyl-5-[[3-(4-chlorophenyl)sulfinylphenyl]methyl]-4H-1,2,3-triazole-5-carboxamide Openeye Name: 4-amino-3-chloro-5-[[3-(4-chlorophenyl)sulfinylphenyl]methyl]-4H-triazole-5-carboxamide CAS Name: 4-amino-3-chloro-5-[[3-(4-chlorophenyl)sulfinylphenyl]methyl]-4H-triazole-5-carboxamide IUPAC Name: 4-amino-3-chloro-5-[[3-(4-chlorophenyl)sulfinylphenyl]methyl]-4H-triazole-5-carboxamide Traditional Name: 4-amino-3-chloro-5-[3-(4-chlorophenyl)sulfinylbenzyl]-4H-triazole-5-carboxamide Formula: C16H15Cl2N5O2S MolecularWeight: 412.2936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)C2=CC=C(C=C2)Cl)CC3(C(N(N=N3)Cl)N)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)C2=CC=C(C=C2)Cl)CC3(C(N(N=N3)Cl)N)C(=O)N

InChI

InChI=1S/C16H15Cl2N5O2S/c17-11-4-6-12(7-5-11)26(25)13-3-1-2-10(8-13)9-16(15(20)24)14(19)23(18)22-21-16/h1-8,14H,9,19H2,(H2,20,24)