N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-methyl-4-phenyl-thiazole-5-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-2-methyl-4-phenyl-5-thiazolecarboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-2-methyl-4-phenyl-thiazole-5-carboxamide Formula: C21H19N3OS2 MolecularWeight: 393.52506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)C(=O)NCCSCC2=CC=CC=C2C#N)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=C(S1)C(=O)NCCSCC2=CC=CC=C2C#N)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3OS2/c1-15-24-19(16-7-3-2-4-8-16)20(27-15)21(25)23-11-12-26-14-18-10-6-5-9-17(18)13-22/h2-10H,11-12,14H2,1H3,(H,23,25)