2-chloranyl-4-methyl-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-chloranyl-4-methyl-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]benzamide Openeye Name: 2-chloro-4-methyl-N-[[4-(morpholinomethyl)phenyl]carbamothioyl]benzamide CAS Name: 2-chloro-4-methyl-N-[[4-(4-morpholinylmethyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-chloro-4-methyl-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]benzamide Traditional Name: 2-chloro-4-methyl-N-[[4-(morpholinomethyl)phenyl]thiocarbamoyl]benzamide Formula: C20H22ClN3O2S MolecularWeight: 403.92558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCOCC3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCOCC3)Cl

InChI

InChI=1S/C20H22ClN3O2S/c1-14-2-7-17(18(21)12-14)19(25)23-20(27)22-16-5-3-15(4-6-16)13-24-8-10-26-11-9-24/h2-7,12H,8-11,13H2,1H3,(H2,22,23,25,27)