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

Systemtic Name: N-[3-[3-methyl-5-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-1,2,4-triazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-[3-methyl-5-[(7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-1,2,4-triazol-4-yl]phenyl]acetamide CAS Name: N-[3-[3-methyl-5-[(7-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-1,2,4-triazol-4-yl]phenyl]acetamide IUPAC Name: N-[3-[3-methyl-5-[(7-methyl-2-oxochromen-4-yl)methylsulfanyl]-1,2,4-triazol-4-yl]phenyl]acetamide Traditional Name: N-[3-[3-[(2-keto-7-methyl-chromen-4-yl)methylthio]-5-methyl-1,2,4-triazol-4-yl]phenyl]acetamide Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(N3C4=CC(=CC=C4)NC(=O)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(N3C4=CC(=CC=C4)NC(=O)C)C

InChI

InChI=1S/C22H20N4O3S/c1-13-7-8-19-16(10-21(28)29-20(19)9-13)12-30-22-25-24-14(2)26(22)18-6-4-5-17(11-18)23-15(3)27/h4-11H,12H2,1-3H3,(H,23,27)