3-chloranyl-N-[[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-chloranyl-N-[[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]phenyl]carbamothioyl]benzamide Openeye Name: 3-chloro-N-[[4-[2-(dimethylamino)-2-oxo-ethyl]phenyl]carbamothioyl]benzamide CAS Name: 3-chloro-N-[[4-[2-(dimethylamino)-2-oxoethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-N-[[4-[2-(dimethylamino)-2-oxoethyl]phenyl]carbamothioyl]benzamide Traditional Name: 3-chloro-N-[[4-[2-(dimethylamino)-2-keto-ethyl]phenyl]thiocarbamoyl]benzamide Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN3O2S/c1-22(2)16(23)10-12-6-8-15(9-7-12)20-18(25)21-17(24)13-4-3-5-14(19)11-13/h3-9,11H,10H2,1-2H3,(H2,20,21,24,25)