N-butan-2-yl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide

Systemtic Name: N-butan-2-yl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide Openeye Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-[(3-methyl-1-oxobutyl)amino]benzamide IUPAC Name: N-butan-2-yl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide Traditional Name: 5-(isovalerylamino)-2-[4-(2-methoxyphenyl)piperazino]-N-sec-butyl-benzamide Formula: C27H38N4O3 MolecularWeight: 466.61562

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)CC(C)C)N2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)CC(C)C)N2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C27H38N4O3/c1-6-20(4)28-27(33)22-18-21(29-26(32)17-19(2)3)11-12-23(22)30-13-15-31(16-14-30)24-9-7-8-10-25(24)34-5/h7-12,18-20H,6,13-17H2,1-5H3,(H,28,33)(H,29,32)