6,7-dimethyl-4-[(thiophen-2-ylmethylamino)methyl]chromen-2-one

Systemtic Name: 6,7-dimethyl-4-[(thiophen-2-ylmethylamino)methyl]chromen-2-one Openeye Name: 6,7-dimethyl-4-[(2-thienylmethylamino)methyl]chromen-2-one CAS Name: 6,7-dimethyl-4-[(thiophen-2-ylmethylamino)methyl]-1-benzopyran-2-one IUPAC Name: 6,7-dimethyl-4-[(thiophen-2-ylmethylamino)methyl]chromen-2-one Traditional Name: 6,7-dimethyl-4-[(2-thenylamino)methyl]coumarin Formula: C17H17NO2S MolecularWeight: 299.38738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CNCC3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CNCC3=CC=CS3)C

InChI

InChI=1S/C17H17NO2S/c1-11-6-15-13(9-18-10-14-4-3-5-21-14)8-17(19)20-16(15)7-12(11)2/h3-8,18H,9-10H2,1-2H3