N-methyl-2-[3-(4-methylpiperazin-1-yl)carbonyl-5-thiophen-2-yl-pyrazol-1-yl]-N-(1-methylpiperidin-4-yl)ethanamide

Systemtic Name: N-methyl-2-[3-(4-methylpiperazin-1-yl)carbonyl-5-thiophen-2-yl-pyrazol-1-yl]-N-(1-methylpiperidin-4-yl)ethanamide Openeye Name: N-methyl-2-[3-(4-methylpiperazine-1-carbonyl)-5-(2-thienyl)pyrazol-1-yl]-N-(1-methyl-4-piperidyl)acetamide CAS Name: N-methyl-2-[3-[(4-methyl-1-piperazinyl)-oxomethyl]-5-thiophen-2-yl-1-pyrazolyl]-N-(1-methyl-4-piperidinyl)acetamide IUPAC Name: N-methyl-2-[3-(4-methylpiperazine-1-carbonyl)-5-thiophen-2-ylpyrazol-1-yl]-N-(1-methylpiperidin-4-yl)acetamide Traditional Name: N-methyl-2-[3-(4-methylpiperazine-1-carbonyl)-5-(2-thienyl)pyrazol-1-yl]-N-(1-methyl-4-piperidyl)acetamide Formula: C22H32N6O2S MolecularWeight: 444.59348

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)C(=O)CN2C(=CC(=N2)C(=O)N3CCN(CC3)C)C4=CC=CS4

Isomeric SMILES

CN1CCC(CC1)N(C)C(=O)CN2C(=CC(=N2)C(=O)N3CCN(CC3)C)C4=CC=CS4

InChI

InChI=1S/C22H32N6O2S/c1-24-8-6-17(7-9-24)26(3)21(29)16-28-19(20-5-4-14-31-20)15-18(23-28)22(30)27-12-10-25(2)11-13-27/h4-5,14-15,17H,6-13,16H2,1-3H3