2-[1-(3-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-5-prop-2-enyl-1H-pyrimidine-4,6-dione

Systemtic Name: 2-[1-(3-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-5-prop-2-enyl-1H-pyrimidine-4,6-dione Openeye Name: 5-allyl-2-[1-(3-methoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-1H-pyrimidine-4,6-dione CAS Name: 2-[[1-(3-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]-5-prop-2-enyl-1H-pyrimidine-4,6-dione IUPAC Name: 2-[1-(3-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl-5-prop-2-enyl-1H-pyrimidine-4,6-dione Traditional Name: 5-allyl-2-[[2,5-diketo-1-(3-methoxyphenyl)pyrrolidin-3-yl]thio]-1H-pyrimidine-4,6-quinone Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)CC(C2=O)SC3=NC(=O)C(C(=O)N3)CC=C

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)CC(C2=O)SC3=NC(=O)C(C(=O)N3)CC=C

InChI

InChI=1S/C18H17N3O5S/c1-3-5-12-15(23)19-18(20-16(12)24)27-13-9-14(22)21(17(13)25)10-6-4-7-11(8-10)26-2/h3-4,6-8,12-13H,1,5,9H2,2H3,(H,19,20,23,24)