6-azanyl-5-[4-chloranyl-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-phenyl]carbonyl-1-methyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[4-chloranyl-3-[(3S)-3-methylpiperidin-1-yl]sulfonyl-phenyl]carbonyl-1-methyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[4-chloro-3-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzoyl]-1-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[[4-chloro-3-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenyl]-oxomethyl]-1-methylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[4-chloro-3-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzoyl]-1-methylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[4-chloro-3-[(3S)-3-methylpiperidino]sulfonyl-benzoyl]-1-methyl-pyrimidine-2,4-quinone Formula: C18H21ClN4O5S MolecularWeight: 440.90114

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)C3=C(N(C(=O)NC3=O)C)N)Cl

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)C3=C(N(C(=O)NC3=O)C)N)Cl

InChI

InChI=1S/C18H21ClN4O5S/c1-10-4-3-7-23(9-10)29(27,28)13-8-11(5-6-12(13)19)15(24)14-16(20)22(2)18(26)21-17(14)25/h5-6,8,10H,3-4,7,9,20H2,1-2H3,(H,21,25,26)/t10-/m0/s1