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

Systemtic Name: N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide Openeye Name: N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide CAS Name: N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-[(3-methyl-1-oxobutyl)amino]benzamide IUPAC Name: N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide Traditional Name: N-(2-diethylaminoethyl)-5-(isovalerylamino)-2-[4-(2-methoxyphenyl)piperazino]benzamide Formula: C29H43N5O3 MolecularWeight: 509.68342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H43N5O3/c1-6-32(7-2)15-14-30-29(36)24-21-23(31-28(35)20-22(3)4)12-13-25(24)33-16-18-34(19-17-33)26-10-8-9-11-27(26)37-5/h8-13,21-22H,6-7,14-20H2,1-5H3,(H,30,36)(H,31,35)