2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-2-oxidanylidene-chromen-7-yl)ethanamide

Systemtic Name: 2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-2-oxidanylidene-chromen-7-yl)ethanamide Openeye Name: 2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-2-oxo-chromen-7-yl)acetamide CAS Name: 2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-(4-methyl-2-oxo-1-benzopyran-7-yl)acetamide IUPAC Name: 2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-2-oxochromen-7-yl)acetamide Traditional Name: 2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-(2-keto-4-methyl-chromen-7-yl)acetamide Formula: C21H17BrN4O3S MolecularWeight: 485.35368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)CSC3=NN=C(N3C)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)CSC3=NN=C(N3C)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H17BrN4O3S/c1-12-9-19(28)29-17-10-15(7-8-16(12)17)23-18(27)11-30-21-25-24-20(26(21)2)13-3-5-14(22)6-4-13/h3-10H,11H2,1-2H3,(H,23,27)