(E)-N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-3-(5-methylfuran-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-3-(5-methylfuran-2-yl)prop-2-enamide Openeye Name: (E)-N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-3-(5-methyl-2-furyl)prop-2-enamide CAS Name: (E)-N-[[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(5-methyl-2-furanyl)-2-propenamide IUPAC Name: (E)-N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-3-(5-methylfuran-2-yl)prop-2-enamide Traditional Name: (E)-N-[[(4-tert-butylbenzoyl)amino]thiocarbamoyl]-3-(5-methyl-2-furyl)acrylamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=CC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=CC=C(O1)/C=C/C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C20H23N3O3S/c1-13-5-10-16(26-13)11-12-17(24)21-19(27)23-22-18(25)14-6-8-15(9-7-14)20(2,3)4/h5-12H,1-4H3,(H,22,25)(H2,21,23,24,27)/b12-11+