4-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-6-methyl-2-(3-nitrophenyl)pyrimidine

Systemtic Name: 4-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-6-methyl-2-(3-nitrophenyl)pyrimidine Openeye Name: 4-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-6-methyl-2-(3-nitrophenyl)pyrimidine CAS Name: 4-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-6-methyl-2-(3-nitrophenyl)pyrimidine IUPAC Name: 4-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-6-methyl-2-(3-nitrophenyl)pyrimidine Traditional Name: 4-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-6-methyl-2-(3-nitrophenyl)pyrimidine Formula: C19H18ClN5O4S2 MolecularWeight: 479.96032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC(=CC=C2)[N+](=O)[O-])N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC(=CC=C2)[N+](=O)[O-])N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C19H18ClN5O4S2/c1-13-11-17(22-19(21-13)14-3-2-4-15(12-14)25(26)27)23-7-9-24(10-8-23)31(28,29)18-6-5-16(20)30-18/h2-6,11-12H,7-10H2,1H3