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

Systemtic Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)-N-(3-morpholinopropyl)benzamide CAS Name: 2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-[(3-methyl-1-oxobutyl)amino]-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: 5-(isovalerylamino)-2-[4-(2-methoxyphenyl)piperazino]-N-(3-morpholinopropyl)benzamide Formula: C30H43N5O4 MolecularWeight: 537.69352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCCCN4CCOCC4

Isomeric SMILES

CC(C)CC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C30H43N5O4/c1-23(2)21-29(36)32-24-9-10-26(25(22-24)30(37)31-11-6-12-33-17-19-39-20-18-33)34-13-15-35(16-14-34)27-7-4-5-8-28(27)38-3/h4-5,7-10,22-23H,6,11-21H2,1-3H3,(H,31,37)(H,32,36)