[1-(2-azanylpyrimidin-4-yl)-3-[2-(5-chloranyl-2-methoxy-phenoxy)ethyl]-4-methyl-3-[3-(methylamino)propyl]piperazin-2-ylidene]methanone

Systemtic Name: [1-(2-azanylpyrimidin-4-yl)-3-[2-(5-chloranyl-2-methoxy-phenoxy)ethyl]-4-methyl-3-[3-(methylamino)propyl]piperazin-2-ylidene]methanone Openeye Name: [1-(2-aminopyrimidin-4-yl)-3-[2-(5-chloro-2-methoxy-phenoxy)ethyl]-4-methyl-3-[3-(methylamino)propyl]piperazin-2-ylidene]methanone CAS Name: [1-(2-amino-4-pyrimidinyl)-3-[2-(5-chloro-2-methoxyphenoxy)ethyl]-4-methyl-3-[3-(methylamino)propyl]-2-piperazinylidene]methanone IUPAC Name: [1-(2-aminopyrimidin-4-yl)-3-[2-(5-chloro-2-methoxyphenoxy)ethyl]-4-methyl-3-[3-(methylamino)propyl]piperazin-2-ylidene]methanone Traditional Name: [1-(2-aminopyrimidin-4-yl)-3-[2-(5-chloro-2-methoxy-phenoxy)ethyl]-4-methyl-3-[3-(methylamino)propyl]piperazin-2-ylidene]methanone Formula: C23H31ClN6O3 MolecularWeight: 474.98364

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCC1(C(=C=O)N(CCN1C)C2=NC(=NC=C2)N)CCOC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CNCCCC1(C(=C=O)N(CCN1C)C2=NC(=NC=C2)N)CCOC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C23H31ClN6O3/c1-26-10-4-8-23(9-14-33-19-15-17(24)5-6-18(19)32-3)20(16-31)30(13-12-29(23)2)21-7-11-27-22(25)28-21/h5-7,11,15,26H,4,8-10,12-14H2,1-3H3,(H2,25,27,28)