N-(2-diethylaminoethyl)-4-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(2-diethylaminoethyl)-4-[[4-(2-phenoxyethoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: N-(2-diethylaminoethyl)-4-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide CAS Name: N-(2-diethylaminoethyl)-4-[[[[oxo-[4-(2-phenoxyethoxy)phenyl]methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(2-diethylaminoethyl)-4-[[4-(2-phenoxyethoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-(2-diethylaminoethyl)-4-[[4-(2-phenoxyethoxy)benzoyl]thiocarbamoylamino]benzamide Formula: C29H34N4O4S MolecularWeight: 534.66966

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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=C(C=C2)OCCOC3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3

InChI

InChI=1S/C29H34N4O4S/c1-3-33(4-2)19-18-30-27(34)22-10-14-24(15-11-22)31-29(38)32-28(35)23-12-16-26(17-13-23)37-21-20-36-25-8-6-5-7-9-25/h5-17H,3-4,18-21H2,1-2H3,(H,30,34)(H2,31,32,35,38)