4-methoxy-N-[[5-[2-oxidanylidene-2-(thiophen-2-ylamino)ethyl]sulfanyl-4-phenethyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 4-methoxy-N-[[5-[2-oxidanylidene-2-(thiophen-2-ylamino)ethyl]sulfanyl-4-phenethyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 4-methoxy-N-[[5-[2-oxo-2-(2-thienylamino)ethyl]sulfanyl-4-phenethyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 4-methoxy-N-[[5-[[2-oxo-2-(thiophen-2-ylamino)ethyl]thio]-4-phenethyl-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-methoxy-N-[[5-[2-oxo-2-(thiophen-2-ylamino)ethyl]sulfanyl-4-phenethyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: N-[[5-[[2-keto-2-(2-thienylamino)ethyl]thio]-4-phenethyl-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide Formula: C25H25N5O3S2 MolecularWeight: 507.6277

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2CCC3=CC=CC=C3)SCC(=O)NC4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2CCC3=CC=CC=C3)SCC(=O)NC4=CC=CS4

InChI

InChI=1S/C25H25N5O3S2/c1-33-20-11-9-19(10-12-20)24(32)26-16-21-28-29-25(30(21)14-13-18-6-3-2-4-7-18)35-17-22(31)27-23-8-5-15-34-23/h2-12,15H,13-14,16-17H2,1H3,(H,26,32)(H,27,31)