7-methyl-4-[[(2-methyl-5-methylsulfonyl-phenyl)amino]methyl]-6-propan-2-yl-chromen-2-one

Systemtic Name: 7-methyl-4-[[(2-methyl-5-methylsulfonyl-phenyl)amino]methyl]-6-propan-2-yl-chromen-2-one Openeye Name: 6-isopropyl-7-methyl-4-[(2-methyl-5-methylsulfonyl-anilino)methyl]chromen-2-one CAS Name: 7-methyl-4-[(2-methyl-5-methylsulfonylanilino)methyl]-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 7-methyl-4-[(2-methyl-5-methylsulfonylanilino)methyl]-6-propan-2-ylchromen-2-one Traditional Name: 6-isopropyl-4-[(5-mesyl-2-methyl-anilino)methyl]-7-methyl-coumarin Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NCC2=CC(=O)OC3=CC(=C(C=C23)C(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NCC2=CC(=O)OC3=CC(=C(C=C23)C(C)C)C

InChI

InChI=1S/C22H25NO4S/c1-13(2)18-11-19-16(9-22(24)27-21(19)8-15(18)4)12-23-20-10-17(28(5,25)26)7-6-14(20)3/h6-11,13,23H,12H2,1-5H3