4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-7-methyl-6-propan-2-yl-chromen-2-one

Systemtic Name: 4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-7-methyl-6-propan-2-yl-chromen-2-one Openeye Name: 4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-6-isopropyl-7-methyl-chromen-2-one CAS Name: 4-[[(1-cyclopropyl-2-imidazolyl)thio]methyl]-7-methyl-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-7-methyl-6-propan-2-ylchromen-2-one Traditional Name: 4-[[(1-cyclopropylimidazol-2-yl)thio]methyl]-6-isopropyl-7-methyl-coumarin Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC=CN3C4CC4)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC=CN3C4CC4)C(C)C

InChI

InChI=1S/C20H22N2O2S/c1-12(2)16-10-17-14(9-19(23)24-18(17)8-13(16)3)11-25-20-21-6-7-22(20)15-4-5-15/h6-10,12,15H,4-5,11H2,1-3H3