7-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]-4-methyl-chromen-2-one

Systemtic Name: 7-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]-4-methyl-chromen-2-one Openeye Name: 7-[2-[2,5-dimethyl-1-(2-thienylmethyl)pyrrol-3-yl]-2-oxo-ethoxy]-4-methyl-chromen-2-one CAS Name: 7-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)-3-pyrrolyl]-2-oxoethoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxoethoxy]-4-methylchromen-2-one Traditional Name: 7-[2-[2,5-dimethyl-1-(2-thenyl)pyrrol-3-yl]-2-keto-ethoxy]-4-methyl-coumarin Formula: C23H21NO4S MolecularWeight: 407.48214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)C3=C(N(C(=C3)C)CC4=CC=CS4)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)C3=C(N(C(=C3)C)CC4=CC=CS4)C

InChI

InChI=1S/C23H21NO4S/c1-14-9-23(26)28-22-11-17(6-7-19(14)22)27-13-21(25)20-10-15(2)24(16(20)3)12-18-5-4-8-29-18/h4-11H,12-13H2,1-3H3