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

Systemtic Name: N-[(4-fluorophenyl)-thiophen-2-yl-methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[(4-fluorophenyl)-(2-thienyl)methyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[(4-fluorophenyl)-(2-thienyl)methyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C20H17FN4OS3 MolecularWeight: 444.568583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17FN4OS3/c21-14-7-5-13(6-8-14)18(15-3-1-11-28-15)22-17(26)9-10-25-19(23-24-20(25)27)16-4-2-12-29-16/h1-8,11-12,18H,9-10H2,(H,22,26)(H,24,27)