3-[4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]carbonyl-1H-pyridazin-6-one

Systemtic Name: 3-[4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]carbonyl-1H-pyridazin-6-one Openeye Name: 3-[4-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]piperidine-1-carbonyl]-1H-pyridazin-6-one CAS Name: 3-[[4-[4-(4-bromophenyl)-5-methyl-2-thiazolyl]-1-piperidinyl]-oxomethyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidine-1-carbonyl]-1H-pyridazin-6-one Traditional Name: 3-[4-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]piperidine-1-carbonyl]-1H-pyridazin-6-one Formula: C20H19BrN4O2S MolecularWeight: 459.35946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2CCN(CC2)C(=O)C3=NNC(=O)C=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(N=C(S1)C2CCN(CC2)C(=O)C3=NNC(=O)C=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H19BrN4O2S/c1-12-18(13-2-4-15(21)5-3-13)22-19(28-12)14-8-10-25(11-9-14)20(27)16-6-7-17(26)24-23-16/h2-7,14H,8-11H2,1H3,(H,24,26)