3-[4-methyl-5-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-methyl-5-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-methyl-5-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methylthio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-methyl-5-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methylthio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(N3C)CCC(=O)N)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(N3C)CCC(=O)N)C(C)C

InChI

InChI=1S/C20H24N4O3S/c1-11(2)14-9-15-13(8-19(26)27-16(15)7-12(14)3)10-28-20-23-22-18(24(20)4)6-5-17(21)25/h7-9,11H,5-6,10H2,1-4H3,(H2,21,25)