(E)-N-(1-adamantylcarbamothioyl)-3-(4-propan-2-ylphenyl)prop-2-enamide

Systemtic Name: (E)-N-(1-adamantylcarbamothioyl)-3-(4-propan-2-ylphenyl)prop-2-enamide Openeye Name: (E)-N-(1-adamantylcarbamothioyl)-3-(4-isopropylphenyl)prop-2-enamide CAS Name: (E)-N-[(1-adamantylamino)-sulfanylidenemethyl]-3-(4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-N-(1-adamantylcarbamothioyl)-3-(4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-N-(1-adamantylthiocarbamoyl)-3-p-cumenyl-acrylamide Formula: C23H30N2OS MolecularWeight: 382.5621

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H30N2OS/c1-15(2)20-6-3-16(4-7-20)5-8-21(26)24-22(27)25-23-12-17-9-18(13-23)11-19(10-17)14-23/h3-8,15,17-19H,9-14H2,1-2H3,(H2,24,25,26,27)/b8-5+