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

Systemtic Name: N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-3,4-dimethoxy-benzamide Openeye Name: N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-3,4-dimethoxy-benzamide CAS Name: N-[[4-(diethylaminomethyl)anilino]-sulfanylidenemethyl]-3,4-dimethoxybenzamide IUPAC Name: N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-3,4-dimethoxybenzamide Traditional Name: N-[[4-(diethylaminomethyl)phenyl]thiocarbamoyl]-3,4-dimethoxy-benzamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O3S/c1-5-24(6-2)14-15-7-10-17(11-8-15)22-21(28)23-20(25)16-9-12-18(26-3)19(13-16)27-4/h7-13H,5-6,14H2,1-4H3,(H2,22,23,25,28)