7-ethyl-4-[[[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methylamino]methyl]chromen-2-one

Systemtic Name: 7-ethyl-4-[[[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methylamino]methyl]chromen-2-one Openeye Name: 7-ethyl-4-[[[5-(2-methylthiazol-4-yl)-2-thienyl]methylamino]methyl]chromen-2-one CAS Name: 7-ethyl-4-[[[5-(2-methyl-4-thiazolyl)-2-thiophenyl]methylamino]methyl]-1-benzopyran-2-one IUPAC Name: 7-ethyl-4-[[[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methylamino]methyl]chromen-2-one Traditional Name: 7-ethyl-4-[[[5-(2-methylthiazol-4-yl)-2-thienyl]methylamino]methyl]coumarin Formula: C21H20N2O2S2 MolecularWeight: 396.5257

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CNCC3=CC=C(S3)C4=CSC(=N4)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CNCC3=CC=C(S3)C4=CSC(=N4)C

InChI

InChI=1S/C21H20N2O2S2/c1-3-14-4-6-17-15(9-21(24)25-19(17)8-14)10-22-11-16-5-7-20(27-16)18-12-26-13(2)23-18/h4-9,12,22H,3,10-11H2,1-2H3