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

Systemtic Name: 2-[2-oxidanylidene-2-[4-(1-phenylethyl)piperazin-1-yl]ethyl]sulfanyl-3-prop-2-enyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[2-oxo-2-[4-(1-phenylethyl)piperazin-1-yl]ethyl]sulfanyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[2-oxo-2-[4-(1-phenylethyl)-1-piperazinyl]ethyl]thio]-3-prop-2-enyl-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-[2-oxo-2-[4-(1-phenylethyl)piperazin-1-yl]ethyl]sulfanyl-3-prop-2-enylthieno[3,2-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[[2-keto-2-[4-(1-phenylethyl)piperazino]ethyl]thio]thieno[3,2-d]pyrimidin-4-one Formula: C23H26N4O2S2 MolecularWeight: 454.60814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2CCN(CC2)C(=O)CSC3=NC4=C(C(=O)N3CC=C)SC=C4

Isomeric SMILES

CC(C1=CC=CC=C1)N2CCN(CC2)C(=O)CSC3=NC4=C(C(=O)N3CC=C)SC=C4

InChI

InChI=1S/C23H26N4O2S2/c1-3-10-27-22(29)21-19(9-15-30-21)24-23(27)31-16-20(28)26-13-11-25(12-14-26)17(2)18-7-5-4-6-8-18/h3-9,15,17H,1,10-14,16H2,2H3