2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-chloranyl-2-methoxy-phenyl)propanamide

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-chloranyl-2-methoxy-phenyl)propanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-chloro-2-methoxy-phenyl)propanamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(5-chloro-2-methoxyphenyl)propanamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-chloro-2-methoxyphenyl)propanamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(5-chloro-2-methoxy-phenyl)propionamide Formula: C12H14ClN5O2S MolecularWeight: 327.78986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)Cl)OC)SC2=NNC(=N2)N

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)Cl)OC)SC2=NNC(=N2)N

InChI

InChI=1S/C12H14ClN5O2S/c1-6(21-12-16-11(14)17-18-12)10(19)15-8-5-7(13)3-4-9(8)20-2/h3-6H,1-2H3,(H,15,19)(H3,14,16,17,18)