ethyl (1E)-N-[5-chloranyl-6-[(3S)-4-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-ethyl-piperazin-1-yl]-3-(1,3,4-oxadiazol-2-yl)pyrazin-2-yl]methanimidate

Systemtic Name: ethyl (1E)-N-[5-chloranyl-6-[(3S)-4-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-ethyl-piperazin-1-yl]-3-(1,3,4-oxadiazol-2-yl)pyrazin-2-yl]methanimidate Openeye Name: ethyl (1E)-N-[5-chloro-6-[(3S)-4-[1-[(4-chlorophenyl)methyl]-4-piperidyl]-3-ethyl-piperazin-1-yl]-3-(1,3,4-oxadiazol-2-yl)pyrazin-2-yl]methanimidate CAS Name: (1E)-N-[5-chloro-6-[(3S)-4-[1-[(4-chlorophenyl)methyl]-4-piperidinyl]-3-ethyl-1-piperazinyl]-3-(1,3,4-oxadiazol-2-yl)-2-pyrazinyl]methanimidic acid ethyl ester IUPAC Name: ethyl (1E)-N-[5-chloro-6-[(3S)-4-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-ethylpiperazin-1-yl]-3-(1,3,4-oxadiazol-2-yl)pyrazin-2-yl]methanimidate Traditional Name: (1E)-N-[5-chloro-6-[(3S)-4-[1-(4-chlorobenzyl)-4-piperidyl]-3-ethyl-piperazino]-3-(1,3,4-oxadiazol-2-yl)pyrazin-2-yl]formimidic acid ethyl ester Formula: C27H34Cl2N8O2 MolecularWeight: 573.51726

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCN1C2CCN(CC2)CC3=CC=C(C=C3)Cl)C4=NC(=C(N=C4Cl)C5=NN=CO5)N=COCC

Isomeric SMILES

CC[C@H]1CN(CCN1C2CCN(CC2)CC3=CC=C(C=C3)Cl)C4=NC(=C(N=C4Cl)C5=NN=CO5)/N=C/OCC

InChI

InChI=1S/C27H34Cl2N8O2/c1-3-21-16-36(26-24(29)32-23(27-34-31-18-39-27)25(33-26)30-17-38-4-2)13-14-37(21)22-9-11-35(12-10-22)15-19-5-7-20(28)8-6-19/h5-8,17-18,21-22H,3-4,9-16H2,1-2H3/b30-17+/t21-/m0/s1