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

Systemtic Name: 3-[5-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]-4-(2-methylpropyl)-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-isobutyl-5-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methylthio]-4-(2-methylpropyl)-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methylsulfanyl]-4-(2-methylpropyl)-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-isobutyl-5-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methylthio]-1,2,4-triazol-3-yl]propionamide Formula: C23H30N4O3S MolecularWeight: 442.5743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(N3CC(C)C)CCC(=O)N)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(N3CC(C)C)CCC(=O)N)C(C)C

InChI

InChI=1S/C23H30N4O3S/c1-13(2)11-27-21(7-6-20(24)28)25-26-23(27)31-12-16-9-22(29)30-19-8-15(5)17(14(3)4)10-18(16)19/h8-10,13-14H,6-7,11-12H2,1-5H3,(H2,24,28)