3-chloranyl-N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-4-ethoxy-benzamide

Systemtic Name: 3-chloranyl-N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-4-ethoxy-benzamide Openeye Name: 3-chloro-N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-4-ethoxy-benzamide CAS Name: 3-chloro-N-[[4-(diethylaminomethyl)anilino]-sulfanylidenemethyl]-4-ethoxybenzamide IUPAC Name: 3-chloro-N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-4-ethoxybenzamide Traditional Name: 3-chloro-N-[[4-(diethylaminomethyl)phenyl]thiocarbamoyl]-4-ethoxy-benzamide Formula: C21H26ClN3O2S MolecularWeight: 419.96804

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)Cl

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)Cl

InChI

InChI=1S/C21H26ClN3O2S/c1-4-25(5-2)14-15-7-10-17(11-8-15)23-21(28)24-20(26)16-9-12-19(27-6-3)18(22)13-16/h7-13H,4-6,14H2,1-3H3,(H2,23,24,26,28)