N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]naphthalen-1-yl]thiophene-2-carboxamide

Systemtic Name: N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]naphthalen-1-yl]thiophene-2-carboxamide Openeye Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)carbamothioylamino]-1-naphthyl]thiophene-2-carboxamide CAS Name: N-[4-[[(5-chloro-2,4-dimethoxyanilino)-sulfanylidenemethyl]amino]-1-naphthalenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[(5-chloro-2,4-dimethoxyphenyl)carbamothioylamino]naphthalen-1-yl]thiophene-2-carboxamide Traditional Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)thiocarbamoylamino]-1-naphthyl]thiophene-2-carboxamide Formula: C24H20ClN3O3S2 MolecularWeight: 498.0169

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC2=CC=C(C3=CC=CC=C32)NC(=O)C4=CC=CS4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC2=CC=C(C3=CC=CC=C32)NC(=O)C4=CC=CS4)Cl)OC

InChI

InChI=1S/C24H20ClN3O3S2/c1-30-20-13-21(31-2)19(12-16(20)25)28-24(32)27-18-10-9-17(14-6-3-4-7-15(14)18)26-23(29)22-8-5-11-33-22/h3-13H,1-2H3,(H,26,29)(H2,27,28,32)