6-bromanyl-7-methyl-4-[[methyl(phenyl)amino]methyl]thiochromen-2-one

Systemtic Name: 6-bromanyl-7-methyl-4-[[methyl(phenyl)amino]methyl]thiochromen-2-one Openeye Name: 6-bromo-7-methyl-4-[(N-methylanilino)methyl]thiochromen-2-one CAS Name: 6-bromo-7-methyl-4-[(N-methylanilino)methyl]-1-benzothiopyran-2-one IUPAC Name: 6-bromo-7-methyl-4-[(N-methylanilino)methyl]thiochromen-2-one Traditional Name: 6-bromo-7-methyl-4-[(N-methylanilino)methyl]thiochromen-2-one Formula: C18H16BrNOS MolecularWeight: 374.29474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)SC2=C1)CN(C)C3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)SC2=C1)CN(C)C3=CC=CC=C3)Br

InChI

InChI=1S/C18H16BrNOS/c1-12-8-17-15(10-16(12)19)13(9-18(21)22-17)11-20(2)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3