N-ethyl-2-[[2-(3-methylbutylamino)-3-pyridin-3-yl-propanoyl]amino]-3-(4-phenylmethoxyphenyl)-N-piperidin-1-yl-propanamide

Systemtic Name: N-ethyl-2-[[2-(3-methylbutylamino)-3-pyridin-3-yl-propanoyl]amino]-3-(4-phenylmethoxyphenyl)-N-piperidin-1-yl-propanamide Openeye Name: 3-(4-benzyloxyphenyl)-N-ethyl-2-[[2-(isopentylamino)-3-(3-pyridyl)propanoyl]amino]-N-(1-piperidyl)propanamide CAS Name: N-ethyl-2-[[2-(3-methylbutylamino)-1-oxo-3-(3-pyridinyl)propyl]amino]-3-(4-phenylmethoxyphenyl)-N-(1-piperidinyl)propanamide IUPAC Name: N-ethyl-2-[[2-(3-methylbutylamino)-3-pyridin-3-ylpropanoyl]amino]-3-(4-phenylmethoxyphenyl)-N-piperidin-1-ylpropanamide Traditional Name: 3-(4-benzoxyphenyl)-N-ethyl-2-[[2-(isoamylamino)-3-(3-pyridyl)propanoyl]amino]-N-piperidino-propionamide Formula: C36H49N5O3 MolecularWeight: 599.80596

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C(CC3=CN=CC=C3)NCCC(C)C)N4CCCCC4

Isomeric SMILES

CCN(C(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C(CC3=CN=CC=C3)NCCC(C)C)N4CCCCC4

InChI

InChI=1S/C36H49N5O3/c1-4-41(40-22-9-6-10-23-40)36(43)34(24-29-15-17-32(18-16-29)44-27-30-12-7-5-8-13-30)39-35(42)33(38-21-19-28(2)3)25-31-14-11-20-37-26-31/h5,7-8,11-18,20,26,28,33-34,38H,4,6,9-10,19,21-25,27H2,1-3H3,(H,39,42)