N-(6-azanylhexyl)-1-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-pyrazole-4-carboxamide

Systemtic Name: N-(6-azanylhexyl)-1-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-pyrazole-4-carboxamide Openeye Name: N-(6-aminohexyl)-1-[4-(3-methoxyphenyl)thiazol-2-yl]-5-methyl-pyrazole-4-carboxamide CAS Name: N-(6-aminohexyl)-1-[4-(3-methoxyphenyl)-2-thiazolyl]-5-methyl-4-pyrazolecarboxamide IUPAC Name: N-(6-aminohexyl)-1-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazole-4-carboxamide Traditional Name: N-(6-aminohexyl)-1-[4-(3-methoxyphenyl)thiazol-2-yl]-5-methyl-pyrazole-4-carboxamide Formula: C21H27N5O2S MolecularWeight: 413.53638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC(=CS2)C3=CC(=CC=C3)OC)C(=O)NCCCCCCN

Isomeric SMILES

CC1=C(C=NN1C2=NC(=CS2)C3=CC(=CC=C3)OC)C(=O)NCCCCCCN

InChI

InChI=1S/C21H27N5O2S/c1-15-18(20(27)23-11-6-4-3-5-10-22)13-24-26(15)21-25-19(14-29-21)16-8-7-9-17(12-16)28-2/h7-9,12-14H,3-6,10-11,22H2,1-2H3,(H,23,27)