(2R)-2-azanyl-N-(9-oxidanylidene-8aH-acridin-2-yl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: (2R)-2-azanyl-N-(9-oxidanylidene-8aH-acridin-2-yl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: (2R)-2-amino-3-benzylsulfanyl-N-(9-oxo-8aH-acridin-2-yl)propanamide CAS Name: (2R)-2-amino-N-(9-oxo-8aH-acridin-2-yl)-3-(phenylmethylthio)propanamide IUPAC Name: (2R)-2-amino-3-benzylsulfanyl-N-(9-oxo-8aH-acridin-2-yl)propanamide Traditional Name: (2R)-2-amino-3-(benzylthio)-N-(9-keto-8aH-acridin-2-yl)propionamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(C(=O)NC2=CC3=C(C=C2)N=C4C=CC=CC4C3=O)N

Isomeric SMILES

C1=CC=C(C=C1)CSC[C@@H](C(=O)NC2=CC3=C(C=C2)N=C4C=CC=CC4C3=O)N

InChI

InChI=1S/C23H21N3O2S/c24-19(14-29-13-15-6-2-1-3-7-15)23(28)25-16-10-11-21-18(12-16)22(27)17-8-4-5-9-20(17)26-21/h1-12,17,19H,13-14,24H2,(H,25,28)/t17?,19-/m0/s1