(E)-2-(4-tert-butylphenyl)carbonyl-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-tert-butylphenyl)carbonyl-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-tert-butylbenzoyl)-3-(2-methylthiazol-4-yl)prop-2-enenitrile CAS Name: (E)-2-[(4-tert-butylphenyl)-oxomethyl]-3-(2-methyl-4-thiazolyl)-2-propenenitrile IUPAC Name: (E)-2-(4-tert-butylbenzoyl)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-(4-tert-butylbenzoyl)-3-(2-methylthiazol-4-yl)acrylonitrile Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C=C(C#N)C(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=NC(=CS1)/C=C(\C#N)/C(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C18H18N2OS/c1-12-20-16(11-22-12)9-14(10-19)17(21)13-5-7-15(8-6-13)18(2,3)4/h5-9,11H,1-4H3/b14-9+