6,7-dimethyl-4-[[[(1S)-2-methyl-1-thiophen-2-yl-propyl]amino]methyl]chromen-2-one

Systemtic Name: 6,7-dimethyl-4-[[[(1S)-2-methyl-1-thiophen-2-yl-propyl]amino]methyl]chromen-2-one Openeye Name: 6,7-dimethyl-4-[[[(1S)-2-methyl-1-(2-thienyl)propyl]amino]methyl]chromen-2-one CAS Name: 6,7-dimethyl-4-[[[(1S)-2-methyl-1-thiophen-2-ylpropyl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 6,7-dimethyl-4-[[[(1S)-2-methyl-1-thiophen-2-ylpropyl]amino]methyl]chromen-2-one Traditional Name: 6,7-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(C=C2C(=C1)C(=CC(=O)O2)CNC(C3=CC=CS3)C(C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CN[C@H](C3=CC=CS3)C(C)C)C

InChI

InChI=1S/C20H23NO2S/c1-12(2)20(18-6-5-7-24-18)21-11-15-10-19(22)23-17-9-14(4)13(3)8-16(15)17/h5-10,12,20-21H,11H2,1-4H3/t20-/m0/s1