N-(4-bromanyl-2-methyl-pyrazol-3-yl)-4,5-dipentyl-3,6-dihydro-2H-thiopyran-2-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-pyrazol-3-yl)-4,5-dipentyl-3,6-dihydro-2H-thiopyran-2-carboxamide Openeye Name: N-(4-bromo-2-methyl-pyrazol-3-yl)-4,5-dipentyl-3,6-dihydro-2H-thiopyran-2-carboxamide CAS Name: N-(4-bromo-2-methyl-3-pyrazolyl)-4,5-dipentyl-3,6-dihydro-2H-thiopyran-2-carboxamide IUPAC Name: N-(4-bromo-2-methylpyrazol-3-yl)-4,5-dipentyl-3,6-dihydro-2H-thiopyran-2-carboxamide Traditional Name: 4,5-diamyl-N-(4-bromo-2-methyl-pyrazol-3-yl)-3,6-dihydro-2H-thiopyran-2-carboxamide Formula: C20H32BrN3OS MolecularWeight: 442.45658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(CSC(C1)C(=O)NC2=C(C=NN2C)Br)CCCCC

Isomeric SMILES

CCCCCC1=C(CSC(C1)C(=O)NC2=C(C=NN2C)Br)CCCCC

InChI

InChI=1S/C20H32BrN3OS/c1-4-6-8-10-15-12-18(26-14-16(15)11-9-7-5-2)20(25)23-19-17(21)13-22-24(19)3/h13,18H,4-12,14H2,1-3H3,(H,23,25)