[4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]-(1-methyl-5-nitro-pyrazol-4-yl)methanone

Systemtic Name: [4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]-(1-methyl-5-nitro-pyrazol-4-yl)methanone Openeye Name: [4-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]-1-piperidyl]-(1-methyl-5-nitro-pyrazol-4-yl)methanone CAS Name: [4-[4-(4-bromophenyl)-5-methyl-2-thiazolyl]-1-piperidinyl]-(1-methyl-5-nitro-4-pyrazolyl)methanone IUPAC Name: [4-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]piperidin-1-yl]-(1-methyl-5-nitropyrazol-4-yl)methanone Traditional Name: [4-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]piperidino]-(1-methyl-5-nitro-pyrazol-4-yl)methanone Formula: C20H20BrN5O3S MolecularWeight: 490.3735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2CCN(CC2)C(=O)C3=C(N(N=C3)C)[N+](=O)[O-])C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(N=C(S1)C2CCN(CC2)C(=O)C3=C(N(N=C3)C)[N+](=O)[O-])C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H20BrN5O3S/c1-12-17(13-3-5-15(21)6-4-13)23-18(30-12)14-7-9-25(10-8-14)20(27)16-11-22-24(2)19(16)26(28)29/h3-6,11,14H,7-10H2,1-2H3