4-[[(5-bromanylthiophen-2-yl)methyl-methyl-amino]methyl]-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-[[(5-bromanylthiophen-2-yl)methyl-methyl-amino]methyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[[(5-bromo-2-thiophenyl)methyl-methylamino]methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[(5-bromothiophen-2-yl)methyl-methylamino]methyl]-6,7-dimethylchromen-2-one Traditional Name: 4-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-6,7-dimethyl-coumarin Formula: C18H18BrNO2S MolecularWeight: 392.31002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CN(C)CC3=CC=C(S3)Br)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CN(C)CC3=CC=C(S3)Br)C

InChI

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