2-[3-(2,3-dihydroindol-1-yl)-3-oxidanylidene-propyl]sulfanyl-5,6-dimethyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[3-(2,3-dihydroindol-1-yl)-3-oxidanylidene-propyl]sulfanyl-5,6-dimethyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-(3-indolin-1-yl-3-oxo-propyl)sulfanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[3-(2,3-dihydroindol-1-yl)-3-oxopropyl]thio]-5,6-dimethyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[3-(2,3-dihydroindol-1-yl)-3-oxopropyl]sulfanyl-5,6-dimethyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(3-indolin-1-yl-3-keto-propyl)thio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCCC(=O)N3CCC4=CC=CC=C43)CC=C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCCC(=O)N3CCC4=CC=CC=C43)CC=C)C

InChI

InChI=1S/C22H23N3O2S2/c1-4-11-25-21(27)19-14(2)15(3)29-20(19)23-22(25)28-13-10-18(26)24-12-9-16-7-5-6-8-17(16)24/h4-8H,1,9-13H2,2-3H3