3-[(2-tert-butyl-6-ethyl-phenyl)carbamothioylamino]-2-cyano-prop-2-enamide

Systemtic Name: 3-[(2-tert-butyl-6-ethyl-phenyl)carbamothioylamino]-2-cyano-prop-2-enamide Openeye Name: 3-[(2-tert-butyl-6-ethyl-phenyl)carbamothioylamino]-2-cyano-prop-2-enamide CAS Name: 3-[[(2-tert-butyl-6-ethylanilino)-sulfanylidenemethyl]amino]-2-cyano-2-propenamide IUPAC Name: 3-[(2-tert-butyl-6-ethylphenyl)carbamothioylamino]-2-cyanoprop-2-enamide Traditional Name: 3-[(2-tert-butyl-6-ethyl-phenyl)thiocarbamoylamino]-2-cyano-acrylamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)C(C)(C)C)NC(=S)NC=C(C#N)C(=O)N

Isomeric SMILES

CCC1=C(C(=CC=C1)C(C)(C)C)NC(=S)NC=C(C#N)C(=O)N

InChI

InChI=1S/C17H22N4OS/c1-5-11-7-6-8-13(17(2,3)4)14(11)21-16(23)20-10-12(9-18)15(19)22/h6-8,10H,5H2,1-4H3,(H2,19,22)(H2,20,21,23)