propan-2-yl 2-[[4-(3-azanyl-3-oxidanylidene-propyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: propan-2-yl 2-[[4-(3-azanyl-3-oxidanylidene-propyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: isopropyl 2-[[4-(3-amino-3-oxo-propyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(3-amino-3-oxopropyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[4-(3-amino-3-oxopropyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(3-amino-3-keto-propyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetic acid isopropyl ester Formula: C14H18N4O3S2 MolecularWeight: 354.44772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CSC1=NN=C(N1CCC(=O)N)C2=CC=CS2

Isomeric SMILES

CC(C)OC(=O)CSC1=NN=C(N1CCC(=O)N)C2=CC=CS2

InChI

InChI=1S/C14H18N4O3S2/c1-9(2)21-12(20)8-23-14-17-16-13(10-4-3-7-22-10)18(14)6-5-11(15)19/h3-4,7,9H,5-6,8H2,1-2H3,(H2,15,19)