N-(1-oxidanylidene-1-piperidin-1-yl-propan-2-yl)-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]ethanamide

Systemtic Name: N-(1-oxidanylidene-1-piperidin-1-yl-propan-2-yl)-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]ethanamide Openeye Name: N-[1-methyl-2-oxo-2-(1-piperidyl)ethyl]-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]acetamide CAS Name: N-[1-oxo-1-(1-piperidinyl)propan-2-yl]-2-[[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methylsulfinyl]acetamide IUPAC Name: N-(1-oxo-1-piperidin-1-ylpropan-2-yl)-2-[(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methylsulfinyl]acetamide Traditional Name: N-(2-keto-1-methyl-2-piperidino-ethyl)-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]acetamide Formula: C24H29N5O3S MolecularWeight: 467.58376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)NC(=O)CS(=O)CC2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

CC(C(=O)N1CCCCC1)NC(=O)CS(=O)CC2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C24H29N5O3S/c1-19(24(31)28-14-6-3-7-15-28)26-22(30)18-33(32)17-20-16-25-29(21-10-4-2-5-11-21)23(20)27-12-8-9-13-27/h2,4-5,8-13,16,19H,3,6-7,14-15,17-18H2,1H3,(H,26,30)