N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]-4-methoxy-benzamide

Systemtic Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]-4-methoxy-benzamide Openeye Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]-4-methoxy-benzamide CAS Name: N-[[3-[(2,2-dimethyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]-4-methoxybenzamide Traditional Name: 4-methoxy-N-[[3-(pivaloylamino)phenyl]thiocarbamoyl]benzamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC

InChI

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