(2S)-2-[2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]ethanoylamino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]ethanoylamino]-N-propyl-propanamide Openeye Name: (2S)-2-[[2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]acetyl]amino]-N-propyl-propanamide CAS Name: (2S)-2-[[2-[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[[2-[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-yl]acetyl]amino]-N-propylpropanamide Traditional Name: (2S)-2-[[2-[4-(2-methoxy-5-methyl-benzyl)piperazino]acetyl]amino]-N-propyl-propionamide Formula: C21H34N4O3 MolecularWeight: 390.51966

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)CN1CCN(CC1)CC2=C(C=CC(=C2)C)OC

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)CN1CCN(CC1)CC2=C(C=CC(=C2)C)OC

InChI

InChI=1S/C21H34N4O3/c1-5-8-22-21(27)17(3)23-20(26)15-25-11-9-24(10-12-25)14-18-13-16(2)6-7-19(18)28-4/h6-7,13,17H,5,8-12,14-15H2,1-4H3,(H,22,27)(H,23,26)/t17-/m0/s1