N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[[4-(diethylaminomethyl)anilino]-sulfanylidenemethyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[[4-(diethylaminomethyl)phenyl]thiocarbamoyl]-3,4,5-trimethoxy-benzamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C22H29N3O4S/c1-6-25(7-2)14-15-8-10-17(11-9-15)23-22(30)24-21(26)16-12-18(27-3)20(29-5)19(13-16)28-4/h8-13H,6-7,14H2,1-5H3,(H2,23,24,26,30)