N-[[3-methoxy-4-(oxolan-2-ylmethoxy)phenyl]methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-[[3-methoxy-4-(oxolan-2-ylmethoxy)phenyl]methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[[3-methoxy-4-(tetrahydrofuran-2-ylmethoxy)phenyl]methyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[[3-methoxy-4-(2-oxolanylmethoxy)phenyl]methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[[3-methoxy-4-(oxolan-2-ylmethoxy)phenyl]methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[3-methoxy-4-(tetrahydrofurfuryloxy)benzyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)CCN2C(=NNC2=S)C3=CC=CS3)OCC4CCCO4

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)CCN2C(=NNC2=S)C3=CC=CS3)OCC4CCCO4

InChI

InChI=1S/C22H26N4O4S2/c1-28-18-12-15(6-7-17(18)30-14-16-4-2-10-29-16)13-23-20(27)8-9-26-21(24-25-22(26)31)19-5-3-11-32-19/h3,5-7,11-12,16H,2,4,8-10,13-14H2,1H3,(H,23,27)(H,25,31)