7,8-dimethyl-4-[(thiophen-2-ylmethylamino)methyl]chromen-2-one

Systemtic Name: 7,8-dimethyl-4-[(thiophen-2-ylmethylamino)methyl]chromen-2-one Openeye Name: 7,8-dimethyl-4-[(2-thienylmethylamino)methyl]chromen-2-one CAS Name: 7,8-dimethyl-4-[(thiophen-2-ylmethylamino)methyl]-1-benzopyran-2-one IUPAC Name: 7,8-dimethyl-4-[(thiophen-2-ylmethylamino)methyl]chromen-2-one Traditional Name: 7,8-dimethyl-4-[(2-thenylamino)methyl]coumarin Formula: C17H17NO2S MolecularWeight: 299.38738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CNCC3=CC=CS3)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CNCC3=CC=CS3)C

InChI

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