2-[(3,4-dimethoxyphenyl)sulfonyl-methyl-amino]-N-(1,7-dipyridin-3-ylheptan-4-yl)-N-methyl-3-phenyl-propanamide

Systemtic Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-methyl-amino]-N-(1,7-dipyridin-3-ylheptan-4-yl)-N-methyl-3-phenyl-propanamide Openeye Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-methyl-amino]-N-methyl-3-phenyl-N-[4-(3-pyridyl)-1-[3-(3-pyridyl)propyl]butyl]propanamide CAS Name: N-[1,7-bis(3-pyridinyl)heptan-4-yl]-2-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]-N-methyl-3-phenylpropanamide IUPAC Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]-N-(1,7-dipyridin-3-ylheptan-4-yl)-N-methyl-3-phenylpropanamide Traditional Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-methyl-amino]-N-methyl-3-phenyl-N-[4-(3-pyridyl)-1-[3-(3-pyridyl)propyl]butyl]propionamide Formula: C36H44N4O5S MolecularWeight: 644.82336

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CCCC1=CN=CC=C1)CCCC2=CN=CC=C2)C(=O)C(CC3=CC=CC=C3)N(C)S(=O)(=O)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN(C(CCCC1=CN=CC=C1)CCCC2=CN=CC=C2)C(=O)C(CC3=CC=CC=C3)N(C)S(=O)(=O)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C36H44N4O5S/c1-39(31(18-8-14-29-16-10-22-37-26-29)19-9-15-30-17-11-23-38-27-30)36(41)33(24-28-12-6-5-7-13-28)40(2)46(42,43)32-20-21-34(44-3)35(25-32)45-4/h5-7,10-13,16-17,20-23,25-27,31,33H,8-9,14-15,18-19,24H2,1-4H3