N-(4-tert-butylphenyl)-4-(3-chloranylpyridin-2-yl)-2-propan-2-yl-piperazine-1-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-4-(3-chloranylpyridin-2-yl)-2-propan-2-yl-piperazine-1-carboxamide Openeye Name: N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridyl)-2-isopropyl-piperazine-1-carboxamide CAS Name: N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-yl-1-piperazinecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-4-(3-chloropyridin-2-yl)-2-propan-2-ylpiperazine-1-carboxamide Traditional Name: N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridyl)-2-isopropyl-piperazine-1-carboxamide Formula: C23H31ClN4O MolecularWeight: 414.97144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CN(CCN1C(=O)NC2=CC=C(C=C2)C(C)(C)C)C3=C(C=CC=N3)Cl

Isomeric SMILES

CC(C)C1CN(CCN1C(=O)NC2=CC=C(C=C2)C(C)(C)C)C3=C(C=CC=N3)Cl

InChI

InChI=1S/C23H31ClN4O/c1-16(2)20-15-27(21-19(24)7-6-12-25-21)13-14-28(20)22(29)26-18-10-8-17(9-11-18)23(3,4)5/h6-12,16,20H,13-15H2,1-5H3,(H,26,29)