2-[2-(cycloheptylamino)-4-oxidanylidene-1,3-thiazol-5-yl]ethanenitrile

Systemtic Name: 2-[2-(cycloheptylamino)-4-oxidanylidene-1,3-thiazol-5-yl]ethanenitrile Openeye Name: 2-[2-(cycloheptylamino)-4-oxo-thiazol-5-yl]acetonitrile CAS Name: 2-[2-(cycloheptylamino)-4-oxo-5-thiazolyl]acetonitrile IUPAC Name: 2-[2-(cycloheptylamino)-4-oxo-1,3-thiazol-5-yl]acetonitrile Traditional Name: 2-[2-(cycloheptylamino)-4-keto-2-thiazolin-5-yl]acetonitrile Formula: C12H17N3OS MolecularWeight: 251.34788

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=NC(=O)C(S2)CC#N

Isomeric SMILES

C1CCCC(CC1)NC2=NC(=O)C(S2)CC#N

InChI

InChI=1S/C12H17N3OS/c13-8-7-10-11(16)15-12(17-10)14-9-5-3-1-2-4-6-9/h9-10H,1-7H2,(H,14,15,16)