N-[(3-chloranyl-2-morpholin-4-yl-phenyl)carbamothioyl]-3,4,5-triethoxy-benzamide

Systemtic Name: N-[(3-chloranyl-2-morpholin-4-yl-phenyl)carbamothioyl]-3,4,5-triethoxy-benzamide Openeye Name: N-[(3-chloro-2-morpholino-phenyl)carbamothioyl]-3,4,5-triethoxy-benzamide CAS Name: N-[[3-chloro-2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-3,4,5-triethoxybenzamide IUPAC Name: N-[(3-chloro-2-morpholin-4-ylphenyl)carbamothioyl]-3,4,5-triethoxybenzamide Traditional Name: N-[(3-chloro-2-morpholino-phenyl)thiocarbamoyl]-3,4,5-triethoxy-benzamide Formula: C24H30ClN3O5S MolecularWeight: 508.0301

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=C(C(=CC=C2)Cl)N3CCOCC3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=C(C(=CC=C2)Cl)N3CCOCC3

InChI

InChI=1S/C24H30ClN3O5S/c1-4-31-19-14-16(15-20(32-5-2)22(19)33-6-3)23(29)27-24(34)26-18-9-7-8-17(25)21(18)28-10-12-30-13-11-28/h7-9,14-15H,4-6,10-13H2,1-3H3,(H2,26,27,29,34)