5-ethyl-1,3-bis[(E)-3-(5-nitrothiophen-2-yl)prop-2-enyl]-6-phenylsulfanyl-pyrimidine-2,4-dione

Systemtic Name: 5-ethyl-1,3-bis[(E)-3-(5-nitrothiophen-2-yl)prop-2-enyl]-6-phenylsulfanyl-pyrimidine-2,4-dione Openeye Name: 5-ethyl-1,3-bis[(E)-3-(5-nitro-2-thienyl)allyl]-6-phenylsulfanyl-pyrimidine-2,4-dione CAS Name: 5-ethyl-1,3-bis[(E)-3-(5-nitro-2-thiophenyl)prop-2-enyl]-6-(phenylthio)pyrimidine-2,4-dione IUPAC Name: 5-ethyl-1,3-bis[(E)-3-(5-nitrothiophen-2-yl)prop-2-enyl]-6-phenylsulfanylpyrimidine-2,4-dione Traditional Name: 5-ethyl-1,3-bis[(E)-3-(5-nitro-2-thienyl)allyl]-6-(phenylthio)pyrimidine-2,4-quinone Formula: C26H22N4O6S3 MolecularWeight: 582.67108

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=O)N(C1=O)CC=CC2=CC=C(S2)[N+](=O)[O-])CC=CC3=CC=C(S3)[N+](=O)[O-])SC4=CC=CC=C4

Isomeric SMILES

CCC1=C(N(C(=O)N(C1=O)C/C=C/C2=CC=C(S2)[N+](=O)[O-])C/C=C/C3=CC=C(S3)[N+](=O)[O-])SC4=CC=CC=C4

InChI

InChI=1S/C26H22N4O6S3/c1-2-21-24(31)27(16-6-10-19-12-14-22(37-19)29(33)34)26(32)28(25(21)39-18-8-4-3-5-9-18)17-7-11-20-13-15-23(38-20)30(35)36/h3-15H,2,16-17H2,1H3/b10-6+,11-7+