N-[4-[(3,4-dimethoxyphenyl)carbonylcarbamothioylamino]-2-methyl-phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[(3,4-dimethoxyphenyl)carbonylcarbamothioylamino]-2-methyl-phenyl]furan-2-carboxamide Openeye Name: N-[4-[(3,4-dimethoxybenzoyl)carbamothioylamino]-2-methyl-phenyl]furan-2-carboxamide CAS Name: N-[4-[[[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-2-methylphenyl]-2-furancarboxamide IUPAC Name: N-[4-[(3,4-dimethoxybenzoyl)carbamothioylamino]-2-methylphenyl]furan-2-carboxamide Traditional Name: N-[2-methyl-4-(veratroylthiocarbamoylamino)phenyl]-2-furamide Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)OC)NC(=O)C3=CC=CO3

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)OC)NC(=O)C3=CC=CO3

InChI

InChI=1S/C22H21N3O5S/c1-13-11-15(7-8-16(13)24-21(27)18-5-4-10-30-18)23-22(31)25-20(26)14-6-9-17(28-2)19(12-14)29-3/h4-12H,1-3H3,(H,24,27)(H2,23,25,26,31)