N-[4-[[3-chloranyl-4-(dimethylamino)phenyl]carbamothioylamino]phenyl]-2-methyl-benzamide

Systemtic Name: N-[4-[[3-chloranyl-4-(dimethylamino)phenyl]carbamothioylamino]phenyl]-2-methyl-benzamide Openeye Name: N-[4-[[3-chloro-4-(dimethylamino)phenyl]carbamothioylamino]phenyl]-2-methyl-benzamide CAS Name: N-[4-[[[3-chloro-4-(dimethylamino)anilino]-sulfanylidenemethyl]amino]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[[3-chloro-4-(dimethylamino)phenyl]carbamothioylamino]phenyl]-2-methylbenzamide Traditional Name: N-[4-[[3-chloro-4-(dimethylamino)phenyl]thiocarbamoylamino]phenyl]-2-methyl-benzamide Formula: C23H23ClN4OS MolecularWeight: 438.97292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)NC(=S)NC3=CC(=C(C=C3)N(C)C)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)NC(=S)NC3=CC(=C(C=C3)N(C)C)Cl

InChI

InChI=1S/C23H23ClN4OS/c1-15-6-4-5-7-19(15)22(29)25-16-8-10-17(11-9-16)26-23(30)27-18-12-13-21(28(2)3)20(24)14-18/h4-14H,1-3H3,(H,25,29)(H2,26,27,30)