6-chloranyl-7-methyl-4-[(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylmethyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[(2-methyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[(2-methyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[[[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]thio]methyl]coumarin Formula: C22H15ClN2O2S3 MolecularWeight: 471.0147

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC(=NC4=C3C(=CS4)C5=CC=CS5)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC(=NC4=C3C(=CS4)C5=CC=CS5)C)Cl

InChI

InChI=1S/C22H15ClN2O2S3/c1-11-6-17-14(8-16(11)23)13(7-19(26)27-17)9-29-21-20-15(18-4-3-5-28-18)10-30-22(20)25-12(2)24-21/h3-8,10H,9H2,1-2H3