2-[3-(phenylmethyl)quinoxalin-2-yl]sulfanyl-N-(4-propan-2-ylphenyl)ethanamide

Systemtic Name: 2-[3-(phenylmethyl)quinoxalin-2-yl]sulfanyl-N-(4-propan-2-ylphenyl)ethanamide Openeye Name: 2-(3-benzylquinoxalin-2-yl)sulfanyl-N-(4-isopropylphenyl)acetamide CAS Name: 2-[[3-(phenylmethyl)-2-quinoxalinyl]thio]-N-(4-propan-2-ylphenyl)acetamide IUPAC Name: 2-(3-benzylquinoxalin-2-yl)sulfanyl-N-(4-propan-2-ylphenyl)acetamide Traditional Name: 2-[(3-benzylquinoxalin-2-yl)thio]-N-p-cumenyl-acetamide Formula: C26H25N3OS MolecularWeight: 427.5612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=CC=C4

InChI

InChI=1S/C26H25N3OS/c1-18(2)20-12-14-21(15-13-20)27-25(30)17-31-26-24(16-19-8-4-3-5-9-19)28-22-10-6-7-11-23(22)29-26/h3-15,18H,16-17H2,1-2H3,(H,27,30)