N-[2-chloranyl-4-[(2-methoxy-3-methyl-phenyl)carbonylcarbamothioylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[2-chloranyl-4-[(2-methoxy-3-methyl-phenyl)carbonylcarbamothioylamino]phenyl]furan-2-carboxamide Openeye Name: N-[2-chloro-4-[(2-methoxy-3-methyl-benzoyl)carbamothioylamino]phenyl]furan-2-carboxamide CAS Name: N-[2-chloro-4-[[[[(2-methoxy-3-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[2-chloro-4-[(2-methoxy-3-methylbenzoyl)carbamothioylamino]phenyl]furan-2-carboxamide Traditional Name: N-[2-chloro-4-[(2-methoxy-3-methyl-benzoyl)thiocarbamoylamino]phenyl]-2-furamide Formula: C21H18ClN3O4S MolecularWeight: 443.90332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CO3)Cl

Isomeric SMILES

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CO3)Cl

InChI

InChI=1S/C21H18ClN3O4S/c1-12-5-3-6-14(18(12)28-2)19(26)25-21(30)23-13-8-9-16(15(22)11-13)24-20(27)17-7-4-10-29-17/h3-11H,1-2H3,(H,24,27)(H2,23,25,26,30)