6-chloranyl-7-methyl-4-[[methyl(thiophen-2-ylmethyl)amino]methyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[[methyl(thiophen-2-ylmethyl)amino]methyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[[methyl(2-thienylmethyl)amino]methyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[methyl(thiophen-2-ylmethyl)amino]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[[methyl(thiophen-2-ylmethyl)amino]methyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[[methyl(2-thenyl)amino]methyl]coumarin Formula: C17H16ClNO2S MolecularWeight: 333.83244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN(C)CC3=CC=CS3)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN(C)CC3=CC=CS3)Cl

InChI

InChI=1S/C17H16ClNO2S/c1-11-6-16-14(8-15(11)18)12(7-17(20)21-16)9-19(2)10-13-4-3-5-22-13/h3-8H,9-10H2,1-2H3