4-chloranyl-N-[(2R,3S)-3-methyl-1-oxidanylidene-1-(4-pyrazin-2-ylpiperazin-1-yl)pentan-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[(2R,3S)-3-methyl-1-oxidanylidene-1-(4-pyrazin-2-ylpiperazin-1-yl)pentan-2-yl]benzamide Openeye Name: 4-chloro-N-[(1R,2S)-2-methyl-1-(4-pyrazin-2-ylpiperazine-1-carbonyl)butyl]benzamide CAS Name: 4-chloro-N-[(2R,3S)-3-methyl-1-oxo-1-[4-(2-pyrazinyl)-1-piperazinyl]pentan-2-yl]benzamide IUPAC Name: 4-chloro-N-[(2R,3S)-3-methyl-1-oxo-1-(4-pyrazin-2-ylpiperazin-1-yl)pentan-2-yl]benzamide Traditional Name: 4-chloro-N-[(1R,2S)-2-methyl-1-(4-pyrazin-2-ylpiperazine-1-carbonyl)butyl]benzamide Formula: C21H26ClN5O2 MolecularWeight: 415.91644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C2=NC=CN=C2)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)N1CCN(CC1)C2=NC=CN=C2)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H26ClN5O2/c1-3-15(2)19(25-20(28)16-4-6-17(22)7-5-16)21(29)27-12-10-26(11-13-27)18-14-23-8-9-24-18/h4-9,14-15,19H,3,10-13H2,1-2H3,(H,25,28)/t15-,19+/m0/s1