2-chloranyl-4-[[4-(1,3-dithian-2-yl)phenyl]carbonylamino]-N,N-diethyl-benzamide

Systemtic Name: 2-chloranyl-4-[[4-(1,3-dithian-2-yl)phenyl]carbonylamino]-N,N-diethyl-benzamide Openeye Name: 2-chloro-4-[[4-(1,3-dithian-2-yl)benzoyl]amino]-N,N-diethyl-benzamide CAS Name: 2-chloro-4-[[[4-(1,3-dithian-2-yl)phenyl]-oxomethyl]amino]-N,N-diethylbenzamide IUPAC Name: 2-chloro-4-[[4-(1,3-dithian-2-yl)benzoyl]amino]-N,N-diethylbenzamide Traditional Name: 2-chloro-4-[[4-(1,3-dithian-2-yl)benzoyl]amino]-N,N-diethyl-benzamide Formula: C22H25ClN2O2S2 MolecularWeight: 449.0291

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C3SCCCS3)Cl

Isomeric SMILES

CCN(CC)C(=O)C1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C3SCCCS3)Cl

InChI

InChI=1S/C22H25ClN2O2S2/c1-3-25(4-2)21(27)18-11-10-17(14-19(18)23)24-20(26)15-6-8-16(9-7-15)22-28-12-5-13-29-22/h6-11,14,22H,3-5,12-13H2,1-2H3,(H,24,26)