(3-ethyl-4-propan-2-yl-piperazin-1-yl)-[6-[(phenylmethyl)amino]pyridin-3-yl]methanone

Systemtic Name: (3-ethyl-4-propan-2-yl-piperazin-1-yl)-[6-[(phenylmethyl)amino]pyridin-3-yl]methanone Openeye Name: [6-(benzylamino)-3-pyridyl]-(3-ethyl-4-isopropyl-piperazin-1-yl)methanone CAS Name: (3-ethyl-4-propan-2-yl-1-piperazinyl)-[6-[(phenylmethyl)amino]-3-pyridinyl]methanone IUPAC Name: [6-(benzylamino)pyridin-3-yl]-(3-ethyl-4-propan-2-ylpiperazin-1-yl)methanone Traditional Name: [6-(benzylamino)-3-pyridyl]-(3-ethyl-4-isopropyl-piperazino)methanone Formula: C22H30N4O MolecularWeight: 366.4998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCN1C(C)C)C(=O)C2=CN=C(C=C2)NCC3=CC=CC=C3

Isomeric SMILES

CCC1CN(CCN1C(C)C)C(=O)C2=CN=C(C=C2)NCC3=CC=CC=C3

InChI

InChI=1S/C22H30N4O/c1-4-20-16-25(12-13-26(20)17(2)3)22(27)19-10-11-21(24-15-19)23-14-18-8-6-5-7-9-18/h5-11,15,17,20H,4,12-14,16H2,1-3H3,(H,23,24)