4-[[(2-bromanyl-4-ethyl-phenyl)amino]methyl]-7-methyl-2H-thiopyrano[3,2-c]pyran-5-one

Systemtic Name: 4-[[(2-bromanyl-4-ethyl-phenyl)amino]methyl]-7-methyl-2H-thiopyrano[3,2-c]pyran-5-one Openeye Name: 4-[(2-bromo-4-ethyl-anilino)methyl]-7-methyl-2H-thiopyrano[3,2-c]pyran-5-one CAS Name: 4-[(2-bromo-4-ethylanilino)methyl]-7-methyl-2H-thiopyrano[3,2-c]pyran-5-one IUPAC Name: 4-[(2-bromo-4-ethylanilino)methyl]-7-methyl-2H-thiopyrano[3,2-c]pyran-5-one Traditional Name: 4-[(2-bromo-4-ethyl-anilino)methyl]-7-methyl-2H-thiopyrano[3,2-c]pyran-5-one Formula: C18H18BrNO2S MolecularWeight: 392.31002

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)NCC2=CCSC3=C2C(=O)OC(=C3)C)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)NCC2=CCSC3=C2C(=O)OC(=C3)C)Br

InChI

InChI=1S/C18H18BrNO2S/c1-3-12-4-5-15(14(19)9-12)20-10-13-6-7-23-16-8-11(2)22-18(21)17(13)16/h4-6,8-9,20H,3,7,10H2,1-2H3