7,8-dimethyl-4-[[[(1S)-2-methyl-1-thiophen-2-yl-propyl]amino]methyl]chromen-2-one

Systemtic Name: 7,8-dimethyl-4-[[[(1S)-2-methyl-1-thiophen-2-yl-propyl]amino]methyl]chromen-2-one Openeye Name: 7,8-dimethyl-4-[[[(1S)-2-methyl-1-(2-thienyl)propyl]amino]methyl]chromen-2-one CAS Name: 7,8-dimethyl-4-[[[(1S)-2-methyl-1-thiophen-2-ylpropyl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 7,8-dimethyl-4-[[[(1S)-2-methyl-1-thiophen-2-ylpropyl]amino]methyl]chromen-2-one Traditional Name: 7,8-dimethyl-4-[[[(1S)-2-methyl-1-(2-thienyl)propyl]amino]methyl]coumarin Formula: C20H23NO2S MolecularWeight: 341.46712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CNC(C3=CC=CS3)C(C)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN[C@H](C3=CC=CS3)C(C)C)C

InChI

InChI=1S/C20H23NO2S/c1-12(2)19(17-6-5-9-24-17)21-11-15-10-18(22)23-20-14(4)13(3)7-8-16(15)20/h5-10,12,19,21H,11H2,1-4H3/t19-/m0/s1