N-[(4-morpholin-4-ylcarbonylphenyl)carbamothioyl]-3-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[(4-morpholin-4-ylcarbonylphenyl)carbamothioyl]-3-(2-phenoxyethoxy)benzamide Openeye Name: N-[[4-(morpholine-4-carbonyl)phenyl]carbamothioyl]-3-(2-phenoxyethoxy)benzamide CAS Name: N-[[4-[4-morpholinyl(oxo)methyl]anilino]-sulfanylidenemethyl]-3-(2-phenoxyethoxy)benzamide IUPAC Name: N-[[4-(morpholine-4-carbonyl)phenyl]carbamothioyl]-3-(2-phenoxyethoxy)benzamide Traditional Name: N-[[4-(morpholine-4-carbonyl)phenyl]thiocarbamoyl]-3-(2-phenoxyethoxy)benzamide Formula: C27H27N3O5S MolecularWeight: 505.58538

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCOC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCOC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O5S/c31-25(21-5-4-8-24(19-21)35-18-17-34-23-6-2-1-3-7-23)29-27(36)28-22-11-9-20(10-12-22)26(32)30-13-15-33-16-14-30/h1-12,19H,13-18H2,(H2,28,29,31,36)