N-[[4-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-3-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[[4-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-3-(2-phenoxyethoxy)benzamide Openeye Name: N-[[4-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-3-(2-phenoxyethoxy)benzamide CAS Name: N-[[4-[(N-ethylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-3-(2-phenoxyethoxy)benzamide IUPAC Name: N-[[4-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-3-(2-phenoxyethoxy)benzamide Traditional Name: N-[[4-[ethyl(phenyl)carbamoyl]phenyl]thiocarbamoyl]-3-(2-phenoxyethoxy)benzamide Formula: C31H29N3O4S MolecularWeight: 539.64466

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCOC4=CC=CC=C4

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCOC4=CC=CC=C4

InChI

InChI=1S/C31H29N3O4S/c1-2-34(26-11-5-3-6-12-26)30(36)23-16-18-25(19-17-23)32-31(39)33-29(35)24-10-9-15-28(22-24)38-21-20-37-27-13-7-4-8-14-27/h3-19,22H,2,20-21H2,1H3,(H2,32,33,35,39)