3,3-dimethyl-N-[2-[4-(2-phenylethanoyl)piperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]butanamide

Systemtic Name: 3,3-dimethyl-N-[2-[4-(2-phenylethanoyl)piperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]butanamide Openeye Name: 3,3-dimethyl-N-[2-[4-(2-phenylacetyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]butanamide CAS Name: 3,3-dimethyl-N-[2-[4-(1-oxo-2-phenylethyl)-1-piperazinyl]-5-[oxo(1-piperazinyl)methyl]phenyl]butanamide IUPAC Name: 3,3-dimethyl-N-[2-[4-(2-phenylacetyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]butanamide Traditional Name: 3,3-dimethyl-N-[2-[4-(2-phenylacetyl)piperazino]-5-(piperazine-1-carbonyl)phenyl]butyramide Formula: C29H39N5O3 MolecularWeight: 505.65166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=C(C=CC(=C1)C(=O)N2CCNCC2)N3CCN(CC3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)CC(=O)NC1=C(C=CC(=C1)C(=O)N2CCNCC2)N3CCN(CC3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C29H39N5O3/c1-29(2,3)21-26(35)31-24-20-23(28(37)34-13-11-30-12-14-34)9-10-25(24)32-15-17-33(18-16-32)27(36)19-22-7-5-4-6-8-22/h4-10,20,30H,11-19,21H2,1-3H3,(H,31,35)