2-[4-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 2-[4-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 2-[4-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]pyrimidine CAS Name: 2-[4-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-(3-chloro-4-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 2-[4-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylpiperazino]pyrimidine Formula: C15H16ClN5O4S MolecularWeight: 397.83664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3)Cl

InChI

InChI=1S/C15H16ClN5O4S/c1-11-13(16)9-12(10-14(11)21(22)23)26(24,25)20-7-5-19(6-8-20)15-17-3-2-4-18-15/h2-4,9-10H,5-8H2,1H3