6-azanyl-2-[(2-azanyl-3-sulfanyl-propanoyl)-(triphenylmethyl)amino]hexanamide

Systemtic Name: 6-azanyl-2-[(2-azanyl-3-sulfanyl-propanoyl)-(triphenylmethyl)amino]hexanamide Openeye Name: 6-amino-2-[(2-amino-3-sulfanyl-propanoyl)-trityl-amino]hexanamide CAS Name: 6-amino-2-[(2-amino-3-mercapto-1-oxopropyl)-(triphenylmethyl)amino]hexanamide IUPAC Name: 6-amino-2-[(2-amino-3-sulfanylpropanoyl)-tritylamino]hexanamide Traditional Name: 6-amino-2-[(2-amino-3-mercapto-propanoyl)-trityl-amino]hexanamide Formula: C28H34N4O2S MolecularWeight: 490.66016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N(C(CCCCN)C(=O)N)C(=O)C(CS)N

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N(C(CCCCN)C(=O)N)C(=O)C(CS)N

InChI

InChI=1S/C28H34N4O2S/c29-19-11-10-18-25(26(31)33)32(27(34)24(30)20-35)28(21-12-4-1-5-13-21,22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-9,12-17,24-25,35H,10-11,18-20,29-30H2,(H2,31,33)