4-[3-[2-(diphenylmethyl)sulfanylethanoyl-ethyl-amino]propanoylamino]benzamide

Systemtic Name: 4-[3-[2-(diphenylmethyl)sulfanylethanoyl-ethyl-amino]propanoylamino]benzamide Openeye Name: 4-[3-[(2-benzhydrylsulfanylacetyl)-ethyl-amino]propanoylamino]benzamide CAS Name: 4-[[3-[[2-[(diphenylmethyl)thio]-1-oxoethyl]-ethylamino]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[3-[(2-benzhydrylsulfanylacetyl)-ethylamino]propanoylamino]benzamide Traditional Name: 4-[3-[[2-(benzhydrylthio)acetyl]-ethyl-amino]propanoylamino]benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC(=O)NC1=CC=C(C=C1)C(=O)N)C(=O)CSC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCN(CCC(=O)NC1=CC=C(C=C1)C(=O)N)C(=O)CSC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-2-30(18-17-24(31)29-23-15-13-22(14-16-23)27(28)33)25(32)19-34-26(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-16,26H,2,17-19H2,1H3,(H2,28,33)(H,29,31)