4-chloranyl-6-[(Z)-3-(4-chlorophenyl)sulfonyl-2-pyrrolidin-1-yl-prop-1-enyl]-2-methyl-5-nitro-pyrimidine

Systemtic Name: 4-chloranyl-6-[(Z)-3-(4-chlorophenyl)sulfonyl-2-pyrrolidin-1-yl-prop-1-enyl]-2-methyl-5-nitro-pyrimidine Openeye Name: 4-chloro-6-[(Z)-3-(4-chlorophenyl)sulfonyl-2-pyrrolidin-1-yl-prop-1-enyl]-2-methyl-5-nitro-pyrimidine CAS Name: 4-chloro-6-[(Z)-3-(4-chlorophenyl)sulfonyl-2-(1-pyrrolidinyl)prop-1-enyl]-2-methyl-5-nitropyrimidine IUPAC Name: 4-chloro-6-[(Z)-3-(4-chlorophenyl)sulfonyl-2-pyrrolidin-1-ylprop-1-enyl]-2-methyl-5-nitropyrimidine Traditional Name: 4-chloro-6-[(Z)-3-(4-chlorophenyl)sulfonyl-2-pyrrolidino-prop-1-enyl]-2-methyl-5-nitro-pyrimidine Formula: C18H18Cl2N4O4S MolecularWeight: 457.33092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)Cl)[N+](=O)[O-])C=C(CS(=O)(=O)C2=CC=C(C=C2)Cl)N3CCCC3

Isomeric SMILES

CC1=NC(=C(C(=N1)Cl)[N+](=O)[O-])/C=C(/CS(=O)(=O)C2=CC=C(C=C2)Cl)\N3CCCC3

InChI

InChI=1S/C18H18Cl2N4O4S/c1-12-21-16(17(24(25)26)18(20)22-12)10-14(23-8-2-3-9-23)11-29(27,28)15-6-4-13(19)5-7-15/h4-7,10H,2-3,8-9,11H2,1H3/b14-10-