2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N,N-bis(2-cyanoethyl)ethanamide

Systemtic Name: 2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N,N-bis(2-cyanoethyl)ethanamide Openeye Name: 2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N,N-bis(2-cyanoethyl)acetamide CAS Name: 2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N,N-bis(2-cyanoethyl)acetamide IUPAC Name: 2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N,N-bis(2-cyanoethyl)acetamide Traditional Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N,N-bis(2-cyanoethyl)acetamide Formula: C17H18N6OS MolecularWeight: 354.42942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C(=N2)SCC(=O)N(CCC#N)CCC#N)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C(=N2)SCC(=O)N(CCC#N)CCC#N)N

InChI

InChI=1S/C17H18N6OS/c18-8-4-10-22(11-5-9-19)16(24)13-25-17-21-15(12-23(17)20)14-6-2-1-3-7-14/h1-3,6-7,12H,4-5,10-11,13,20H2