2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-(3-oxidanyl-1-benzothiophen-2-yl)ethanone

Systemtic Name: 2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-(3-oxidanyl-1-benzothiophen-2-yl)ethanone Openeye Name: 2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-(3-hydroxybenzothiophen-2-yl)ethanone CAS Name: 2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-(3-hydroxy-1-benzothiophen-2-yl)ethanone IUPAC Name: 2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-(3-hydroxy-1-benzothiophen-2-yl)ethanone Traditional Name: 2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-(3-hydroxybenzothiophen-2-yl)ethanone Formula: C19H16N4O2S2 MolecularWeight: 396.48594

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=C(C3=CC=CC=C3S2)O)C4=CC=C(C=C4)N

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=C(C3=CC=CC=C3S2)O)C4=CC=C(C=C4)N

InChI

InChI=1S/C19H16N4O2S2/c1-23-18(11-6-8-12(20)9-7-11)21-22-19(23)26-10-14(24)17-16(25)13-4-2-3-5-15(13)27-17/h2-9,25H,10,20H2,1H3