2-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3,6-diphenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3,6-diphenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxo-ethyl]sulfanyl-3,6-diphenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)-2-oxoethyl]thio]-3,6-diphenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[2-(2,5-dimethyl-1-phenethylpyrrol-3-yl)-2-oxoethyl]sulfanyl-3,6-diphenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-keto-ethyl]thio]-3,6-diphenyl-thieno[2,3-d]pyrimidin-4-one Formula: C34H29N3O2S2 MolecularWeight: 575.74296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CSC3=NC4=C(C=C(S4)C5=CC=CC=C5)C(=O)N3C6=CC=CC=C6

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CSC3=NC4=C(C=C(S4)C5=CC=CC=C5)C(=O)N3C6=CC=CC=C6

InChI

InChI=1S/C34H29N3O2S2/c1-23-20-28(24(2)36(23)19-18-25-12-6-3-7-13-25)30(38)22-40-34-35-32-29(21-31(41-32)26-14-8-4-9-15-26)33(39)37(34)27-16-10-5-11-17-27/h3-17,20-21H,18-19,22H2,1-2H3