3-[2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]chromen-2-one

Systemtic Name: 3-[2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]chromen-2-one Openeye Name: 3-[2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]chromen-2-one CAS Name: 3-[2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-1-benzopyran-2-one IUPAC Name: 3-[2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]chromen-2-one Traditional Name: 3-[2-[[5-(4-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetyl]coumarin Formula: C20H16N4O3S MolecularWeight: 392.43104

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC3=CC=CC=C3OC2=O)C4=CC=C(C=C4)N

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC3=CC=CC=C3OC2=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C20H16N4O3S/c1-24-18(12-6-8-14(21)9-7-12)22-23-20(24)28-11-16(25)15-10-13-4-2-3-5-17(13)27-19(15)26/h2-10H,11,21H2,1H3