3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide

Systemtic Name: 3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide Openeye Name: N-(4-thiazol-2-ylphenyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: 3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-[4-(2-thiazolyl)phenyl]propanamide IUPAC Name: 3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide Traditional Name: N-(4-thiazol-2-ylphenyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C18H15N5OS3 MolecularWeight: 413.5396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NNC(=S)N2CCC(=O)NC3=CC=C(C=C3)C4=NC=CS4

Isomeric SMILES

C1=CSC(=C1)C2=NNC(=S)N2CCC(=O)NC3=CC=C(C=C3)C4=NC=CS4

InChI

InChI=1S/C18H15N5OS3/c24-15(20-13-5-3-12(4-6-13)17-19-8-11-27-17)7-9-23-16(21-22-18(23)25)14-2-1-10-26-14/h1-6,8,10-11H,7,9H2,(H,20,24)(H,22,25)