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

Systemtic Name: 5-methyl-N1-[2-oxidanyl-1-[(phenylmethyl)amino]-5-phenylsulfanyl-pentan-3-yl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[3-(benzylamino)-2-hydroxy-1-(2-phenylsulfanylethyl)propyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[2-hydroxy-1-[(phenylmethyl)amino]-5-(phenylthio)pentan-3-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[1-(benzylamino)-2-hydroxy-5-phenylsulfanylpentan-3-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[3-(benzylamino)-2-hydroxy-1-[2-(phenylthio)ethyl]propyl]-5-methyl-N',N'-dipropyl-isophthalamide Formula: C33H43N3O3S MolecularWeight: 561.77782

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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)O)C

Isomeric SMILES

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

InChI

InChI=1S/C33H43N3O3S/c1-4-17-36(18-5-2)33(39)28-21-25(3)20-27(22-28)32(38)35-30(16-19-40-29-14-10-7-11-15-29)31(37)24-34-23-26-12-8-6-9-13-26/h6-15,20-22,30-31,34,37H,4-5,16-19,23-24H2,1-3H3,(H,35,38)