2-[[2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-prop-2-enyl-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-prop-2-enyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[[2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methylsulfanyl]thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[2-(4-ethoxy-3-methoxyphenyl)-4-thiazolyl]methylthio]-3-prop-2-enyl-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-[[2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-prop-2-enylthieno[3,2-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[[2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methylthio]thieno[3,2-d]pyrimidin-4-one Formula: C22H21N3O3S3 MolecularWeight: 471.61544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)CSC3=NC4=C(C(=O)N3CC=C)SC=C4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)CSC3=NC4=C(C(=O)N3CC=C)SC=C4)OC

InChI

InChI=1S/C22H21N3O3S3/c1-4-9-25-21(26)19-16(8-10-29-19)24-22(25)31-13-15-12-30-20(23-15)14-6-7-17(28-5-2)18(11-14)27-3/h4,6-8,10-12H,1,5,9,13H2,2-3H3