N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]carbamothioyl]-2-methyl-benzamide

Systemtic Name: N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]carbamothioyl]-2-methyl-benzamide Openeye Name: N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]carbamothioyl]-2-methyl-benzamide CAS Name: N-[[4-[(2-diethylaminoethylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-methylbenzamide IUPAC Name: N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]carbamothioyl]-2-methylbenzamide Traditional Name: N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]thiocarbamoyl]-2-methyl-benzamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2C

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2C

InChI

InChI=1S/C22H28N4O2S/c1-4-26(5-2)15-14-23-20(27)17-10-12-18(13-11-17)24-22(29)25-21(28)19-9-7-6-8-16(19)3/h6-13H,4-5,14-15H2,1-3H3,(H,23,27)(H2,24,25,28,29)