1-(4-tert-butylphenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]cyclopropane-1-carboxamide

Systemtic Name: 1-(4-tert-butylphenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]cyclopropane-1-carboxamide Openeye Name: 1-(4-tert-butylphenyl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]cyclopropanecarboxamide CAS Name: 1-(4-tert-butylphenyl)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-1-cyclopropanecarboxamide IUPAC Name: 1-(4-tert-butylphenyl)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]cyclopropane-1-carboxamide Traditional Name: 1-(4-tert-butylphenyl)-N-[6-(3-ketopiperazino)-3-pyridyl]cyclopropanecarboxamide Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2(CC2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2(CC2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C23H28N4O2/c1-22(2,3)16-4-6-17(7-5-16)23(10-11-23)21(29)26-18-8-9-19(25-14-18)27-13-12-24-20(28)15-27/h4-9,14H,10-13,15H2,1-3H3,(H,24,28)(H,26,29)