N1-[1-[(3-methoxyphenyl)methylamino]-2-oxidanyl-5-phenylsulfanyl-pentan-3-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[1-[(3-methoxyphenyl)methylamino]-2-oxidanyl-5-phenylsulfanyl-pentan-3-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[2-hydroxy-3-[(3-methoxyphenyl)methylamino]-1-(2-phenylsulfanylethyl)propyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[2-hydroxy-1-[(3-methoxyphenyl)methylamino]-5-(phenylthio)pentan-3-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[2-hydroxy-1-[(3-methoxyphenyl)methylamino]-5-phenylsulfanylpentan-3-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[2-hydroxy-3-(m-anisylamino)-1-[2-(phenylthio)ethyl]propyl]-5-methyl-N',N'-dipropyl-isophthalamide Formula: C34H45N3O4S MolecularWeight: 591.8038

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CCSC2=CC=CC=C2)C(CNCC3=CC(=CC=C3)OC)O)C

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CCSC2=CC=CC=C2)C(CNCC3=CC(=CC=C3)OC)O)C

InChI

InChI=1S/C34H45N3O4S/c1-5-16-37(17-6-2)34(40)28-20-25(3)19-27(22-28)33(39)36-31(15-18-42-30-13-8-7-9-14-30)32(38)24-35-23-26-11-10-12-29(21-26)41-4/h7-14,19-22,31-32,35,38H,5-6,15-18,23-24H2,1-4H3,(H,36,39)