N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[(4-morpholinosulfonylphenyl)carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[4-(4-morpholinylsulfonyl)anilino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]-3-propoxybenzamide Traditional Name: N-[(4-morpholinosulfonylphenyl)thiocarbamoyl]-3-propoxy-benzamide Formula: C21H25N3O5S2 MolecularWeight: 463.5703

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H25N3O5S2/c1-2-12-29-18-5-3-4-16(15-18)20(25)23-21(30)22-17-6-8-19(9-7-17)31(26,27)24-10-13-28-14-11-24/h3-9,15H,2,10-14H2,1H3,(H2,22,23,25,30)