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

Systemtic Name: 6-chloranyl-4-[[ethyl(thiophen-2-ylmethyl)amino]methyl]-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[[ethyl(2-thienylmethyl)amino]methyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[[ethyl(thiophen-2-ylmethyl)amino]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[ethyl(thiophen-2-ylmethyl)amino]methyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[[ethyl(2-thenyl)amino]methyl]-7-methyl-coumarin Formula: C18H18ClNO2S MolecularWeight: 347.85902

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CS1)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)C

Isomeric SMILES

CCN(CC1=CC=CS1)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)C

InChI

InChI=1S/C18H18ClNO2S/c1-3-20(11-14-5-4-6-23-14)10-13-8-18(21)22-17-7-12(2)16(19)9-15(13)17/h4-9H,3,10-11H2,1-2H3