6-ethyl-2-[2-(1-ethyl-2-phenyl-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-ethyl-2-[2-(1-ethyl-2-phenyl-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-6-ethyl-2-[2-(1-ethyl-2-phenyl-indol-3-yl)-2-oxo-ethyl]sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-ethyl-2-[[2-(1-ethyl-2-phenyl-3-indolyl)-2-oxoethyl]thio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-ethyl-2-[2-(1-ethyl-2-phenylindol-3-yl)-2-oxoethyl]sulfanyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-6-ethyl-2-[[2-(1-ethyl-2-phenyl-indol-3-yl)-2-keto-ethyl]thio]thieno[2,3-d]pyrimidin-4-one Formula: C29H27N3O2S2 MolecularWeight: 513.67358

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC(=O)C3=C(N(C4=CC=CC=C43)CC)C5=CC=CC=C5

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC(=O)C3=C(N(C4=CC=CC=C43)CC)C5=CC=CC=C5

InChI

InChI=1S/C29H27N3O2S2/c1-4-16-32-28(34)22-17-20(5-2)36-27(22)30-29(32)35-18-24(33)25-21-14-10-11-15-23(21)31(6-3)26(25)19-12-8-7-9-13-19/h4,7-15,17H,1,5-6,16,18H2,2-3H3