2-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]thio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[[2-(7-ethyl-1H-indol-3-yl)-2-keto-ethyl]thio]thieno[2,3-d]pyrimidin-4-one Formula: C21H19N3O2S2 MolecularWeight: 409.52446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)CSC3=NC4=C(C=CS4)C(=O)N3CC=C

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)CSC3=NC4=C(C=CS4)C(=O)N3CC=C

InChI

InChI=1S/C21H19N3O2S2/c1-3-9-24-20(26)15-8-10-27-19(15)23-21(24)28-12-17(25)16-11-22-18-13(4-2)6-5-7-14(16)18/h3,5-8,10-11,22H,1,4,9,12H2,2H3