(1-methylbenzotriazol-5-yl)-[4-[3-(6-methylpyridin-2-yl)prop-2-ynylidene]piperidin-1-yl]methanone

Systemtic Name: (1-methylbenzotriazol-5-yl)-[4-[3-(6-methylpyridin-2-yl)prop-2-ynylidene]piperidin-1-yl]methanone Openeye Name: (1-methylbenzotriazol-5-yl)-[4-[3-(6-methyl-2-pyridyl)prop-2-ynylidene]-1-piperidyl]methanone CAS Name: (1-methyl-5-benzotriazolyl)-[4-[3-(6-methyl-2-pyridinyl)prop-2-ynylidene]-1-piperidinyl]methanone IUPAC Name: (1-methylbenzotriazol-5-yl)-[4-[3-(6-methylpyridin-2-yl)prop-2-ynylidene]piperidin-1-yl]methanone Traditional Name: (1-methylbenzotriazol-5-yl)-[4-[3-(6-methyl-2-pyridyl)prop-2-ynylidene]piperidino]methanone Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C#CC=C2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(N=N4)C

Isomeric SMILES

CC1=CC=CC(=N1)C#CC=C2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(N=N4)C

InChI

InChI=1S/C22H21N5O/c1-16-5-3-7-19(23-16)8-4-6-17-11-13-27(14-12-17)22(28)18-9-10-21-20(15-18)24-25-26(21)2/h3,5-7,9-10,15H,11-14H2,1-2H3