3-[(2-cyclopropylquinazolin-4-yl)-(2-methoxyethyl)amino]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one

Systemtic Name: 3-[(2-cyclopropylquinazolin-4-yl)-(2-methoxyethyl)amino]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Openeye Name: 3-[(2-cyclopropylquinazolin-4-yl)-(2-methoxyethyl)amino]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one CAS Name: 3-[(2-cyclopropyl-4-quinazolinyl)-(2-methoxyethyl)amino]-1-(4-ethyl-1-piperazin-4-iumyl)-1-propanone IUPAC Name: 3-[(2-cyclopropylquinazolin-4-yl)-(2-methoxyethyl)amino]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Traditional Name: 3-[(2-cyclopropylquinazolin-4-yl)-(2-methoxyethyl)amino]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Formula: C23H34N5O2+ MolecularWeight: 412.54836

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CCN(CCOC)C2=NC(=NC3=CC=CC=C32)C4CC4

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CCN(CCOC)C2=NC(=NC3=CC=CC=C32)C4CC4

InChI

InChI=1S/C23H33N5O2/c1-3-26-12-14-27(15-13-26)21(29)10-11-28(16-17-30-2)23-19-6-4-5-7-20(19)24-22(25-23)18-8-9-18/h4-7,18H,3,8-17H2,1-2H3/p+1