2-ethoxy-N-[[4-(3-methoxypropylcarbamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-ethoxy-N-[[4-(3-methoxypropylcarbamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 2-ethoxy-N-[[4-(3-methoxypropylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: 2-ethoxy-N-[[4-[(3-methoxypropylamino)-oxomethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-ethoxy-N-[[4-(3-methoxypropylcarbamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 2-ethoxy-N-[[4-(3-methoxypropylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCCCOC

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCCCOC

InChI

InChI=1S/C21H25N3O4S/c1-3-28-18-8-5-4-7-17(18)20(26)24-21(29)23-16-11-9-15(10-12-16)19(25)22-13-6-14-27-2/h4-5,7-12H,3,6,13-14H2,1-2H3,(H,22,25)(H2,23,24,26,29)