2-(1-azanyl-2-phenyl-ethyl)-N-[2-(phenylmethylsulfanyl)ethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(1-azanyl-2-phenyl-ethyl)-N-[2-(phenylmethylsulfanyl)ethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(1-amino-2-phenyl-ethyl)-N-(2-benzylsulfanylethyl)thiazole-4-carboxamide CAS Name: 2-(1-amino-2-phenylethyl)-N-[2-(phenylmethylthio)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-(1-amino-2-phenylethyl)-N-(2-benzylsulfanylethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-(1-amino-2-phenyl-ethyl)-N-[2-(benzylthio)ethyl]thiazole-4-carboxamide Formula: C21H23N3OS2 MolecularWeight: 397.55682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=NC(=CS2)C(=O)NCCSCC3=CC=CC=C3)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C2=NC(=CS2)C(=O)NCCSCC3=CC=CC=C3)N

InChI

InChI=1S/C21H23N3OS2/c22-18(13-16-7-3-1-4-8-16)21-24-19(15-27-21)20(25)23-11-12-26-14-17-9-5-2-6-10-17/h1-10,15,18H,11-14,22H2,(H,23,25)