N-[3-[(3,4-dimethylphenyl)carbonylcarbamothioylamino]-4-methoxy-phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[(3,4-dimethylphenyl)carbonylcarbamothioylamino]-4-methoxy-phenyl]furan-2-carboxamide Openeye Name: N-[3-[(3,4-dimethylbenzoyl)carbamothioylamino]-4-methoxy-phenyl]furan-2-carboxamide CAS Name: N-[3-[[[[(3,4-dimethylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-methoxyphenyl]-2-furancarboxamide IUPAC Name: N-[3-[(3,4-dimethylbenzoyl)carbamothioylamino]-4-methoxyphenyl]furan-2-carboxamide Traditional Name: N-[3-[(3,4-dimethylbenzoyl)thiocarbamoylamino]-4-methoxy-phenyl]-2-furamide Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)NC(=O)C3=CC=CO3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)NC(=O)C3=CC=CO3)OC)C

InChI

InChI=1S/C22H21N3O4S/c1-13-6-7-15(11-14(13)2)20(26)25-22(30)24-17-12-16(8-9-18(17)28-3)23-21(27)19-5-4-10-29-19/h4-12H,1-3H3,(H,23,27)(H2,24,25,26,30)