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

Systemtic Name: 4-[[(5-bromanylthiophen-2-yl)methyl-methyl-amino]methyl]-6-chloranyl-7-methyl-chromen-2-one Openeye Name: 4-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-6-chloro-7-methyl-chromen-2-one CAS Name: 4-[[(5-bromo-2-thiophenyl)methyl-methylamino]methyl]-6-chloro-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[[(5-bromothiophen-2-yl)methyl-methylamino]methyl]-6-chloro-7-methylchromen-2-one Traditional Name: 4-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-6-chloro-7-methyl-coumarin Formula: C17H15BrClNO2S MolecularWeight: 412.7285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN(C)CC3=CC=C(S3)Br)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN(C)CC3=CC=C(S3)Br)Cl

InChI

InChI=1S/C17H15BrClNO2S/c1-10-5-15-13(7-14(10)19)11(6-17(21)22-15)8-20(2)9-12-3-4-16(18)23-12/h3-7H,8-9H2,1-2H3