2-[[4-(3-azanyl-3-oxidanylidene-propyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)propanamide

Systemtic Name: 2-[[4-(3-azanyl-3-oxidanylidene-propyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)propanamide Openeye Name: 2-[[4-(3-amino-3-oxo-propyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)propanamide CAS Name: 2-[[4-(3-amino-3-oxopropyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-N-(4-methoxyphenyl)propanamide IUPAC Name: 2-[[4-(3-amino-3-oxopropyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)propanamide Traditional Name: 2-[[4-(3-amino-3-keto-propyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(4-methoxyphenyl)propionamide Formula: C19H21N5O3S2 MolecularWeight: 431.53174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC)SC2=NN=C(N2CCC(=O)N)C3=CC=CS3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OC)SC2=NN=C(N2CCC(=O)N)C3=CC=CS3

InChI

InChI=1S/C19H21N5O3S2/c1-12(18(26)21-13-5-7-14(27-2)8-6-13)29-19-23-22-17(15-4-3-11-28-15)24(19)10-9-16(20)25/h3-8,11-12H,9-10H2,1-2H3,(H2,20,25)(H,21,26)