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

Systemtic Name: N-ethyl-2-[[2-(3-methylbutylamino)-3-pyridin-4-yl-propanoyl]amino]-3-(4-phenylmethoxyphenyl)-N-piperidin-1-yl-propanamide Openeye Name: 3-(4-benzyloxyphenyl)-N-ethyl-2-[[2-(isopentylamino)-3-(4-pyridyl)propanoyl]amino]-N-(1-piperidyl)propanamide CAS Name: N-ethyl-2-[[2-(3-methylbutylamino)-1-oxo-3-pyridin-4-ylpropyl]amino]-3-(4-phenylmethoxyphenyl)-N-(1-piperidinyl)propanamide IUPAC Name: N-ethyl-2-[[2-(3-methylbutylamino)-3-pyridin-4-ylpropanoyl]amino]-3-(4-phenylmethoxyphenyl)-N-piperidin-1-ylpropanamide Traditional Name: 3-(4-benzoxyphenyl)-N-ethyl-2-[[2-(isoamylamino)-3-(4-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=CC=NC=C3)NCCC(C)C)N4CCCCC4

Isomeric SMILES

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

InChI

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