N-(1-adamantyl)-4-[1-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-pyrazol-4-yl]carbonyl-2-methyl-piperazine-1-carboxamide

Systemtic Name: N-(1-adamantyl)-4-[1-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-pyrazol-4-yl]carbonyl-2-methyl-piperazine-1-carboxamide Openeye Name: N-(1-adamantyl)-4-[1-[4-(3-methoxyphenyl)thiazol-2-yl]-5-methyl-pyrazole-4-carbonyl]-2-methyl-piperazine-1-carboxamide CAS Name: N-(1-adamantyl)-4-[[1-[4-(3-methoxyphenyl)-2-thiazolyl]-5-methyl-4-pyrazolyl]-oxomethyl]-2-methyl-1-piperazinecarboxamide IUPAC Name: N-(1-adamantyl)-4-[1-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazole-4-carbonyl]-2-methylpiperazine-1-carboxamide Traditional Name: N-(1-adamantyl)-4-[1-[4-(3-methoxyphenyl)thiazol-2-yl]-5-methyl-pyrazole-4-carbonyl]-2-methyl-piperazine-1-carboxamide Formula: C31H38N6O3S MolecularWeight: 574.73682

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC23CC4CC(C2)CC(C4)C3)C(=O)C5=C(N(N=C5)C6=NC(=CS6)C7=CC(=CC=C7)OC)C

Isomeric SMILES

CC1CN(CCN1C(=O)NC23CC4CC(C2)CC(C4)C3)C(=O)C5=C(N(N=C5)C6=NC(=CS6)C7=CC(=CC=C7)OC)C

InChI

InChI=1S/C31H38N6O3S/c1-19-17-35(7-8-36(19)29(39)34-31-13-21-9-22(14-31)11-23(10-21)15-31)28(38)26-16-32-37(20(26)2)30-33-27(18-41-30)24-5-4-6-25(12-24)40-3/h4-6,12,16,18-19,21-23H,7-11,13-15,17H2,1-3H3,(H,34,39)