6-chloranyl-5-[(3S)-4-[1-(4-chlorophenyl)carbonylpiperidin-4-yl]-3-ethyl-piperazin-1-yl]pyrazine-2-carboxamide

Systemtic Name: 6-chloranyl-5-[(3S)-4-[1-(4-chlorophenyl)carbonylpiperidin-4-yl]-3-ethyl-piperazin-1-yl]pyrazine-2-carboxamide Openeye Name: 6-chloro-5-[(3S)-4-[1-(4-chlorobenzoyl)-4-piperidyl]-3-ethyl-piperazin-1-yl]pyrazine-2-carboxamide CAS Name: 6-chloro-5-[(3S)-4-[1-[(4-chlorophenyl)-oxomethyl]-4-piperidinyl]-3-ethyl-1-piperazinyl]-2-pyrazinecarboxamide IUPAC Name: 6-chloro-5-[(3S)-4-[1-(4-chlorobenzoyl)piperidin-4-yl]-3-ethylpiperazin-1-yl]pyrazine-2-carboxamide Traditional Name: 6-chloro-5-[(3S)-4-[1-(4-chlorobenzoyl)-4-piperidyl]-3-ethyl-piperazino]pyrazinamide Formula: C23H28Cl2N6O2 MolecularWeight: 491.41342

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCN1C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)C4=NC=C(N=C4Cl)C(=O)N

Isomeric SMILES

CC[C@H]1CN(CCN1C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)C4=NC=C(N=C4Cl)C(=O)N

InChI

InChI=1S/C23H28Cl2N6O2/c1-2-17-14-30(22-20(25)28-19(13-27-22)21(26)32)11-12-31(17)18-7-9-29(10-8-18)23(33)15-3-5-16(24)6-4-15/h3-6,13,17-18H,2,7-12,14H2,1H3,(H2,26,32)/t17-/m0/s1