2-[1-[(4-cyanophenyl)methyl]pyrazol-3-yl]-4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide

Systemtic Name: 2-[1-[(4-cyanophenyl)methyl]pyrazol-3-yl]-4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-[1-[(4-cyanophenyl)methyl]pyrazol-3-yl]-4-methyl-N-(3-pyridylmethyl)thiazole-5-carboxamide CAS Name: 2-[1-[(4-cyanophenyl)methyl]-3-pyrazolyl]-4-methyl-N-(3-pyridinylmethyl)-5-thiazolecarboxamide IUPAC Name: 2-[1-[(4-cyanophenyl)methyl]pyrazol-3-yl]-4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide Traditional Name: 2-[1-(4-cyanobenzyl)pyrazol-3-yl]-4-methyl-N-(3-pyridylmethyl)thiazole-5-carboxamide Formula: C22H18N6OS MolecularWeight: 414.48292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=NN(C=C2)CC3=CC=C(C=C3)C#N)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=C(SC(=N1)C2=NN(C=C2)CC3=CC=C(C=C3)C#N)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C22H18N6OS/c1-15-20(21(29)25-13-18-3-2-9-24-12-18)30-22(26-15)19-8-10-28(27-19)14-17-6-4-16(11-23)5-7-17/h2-10,12H,13-14H2,1H3,(H,25,29)