N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[4-(diethylaminomethyl)anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[[4-(diethylaminomethyl)phenyl]thiocarbamoyl]-4-propoxy-benzamide Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN(CC)CC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN(CC)CC

InChI

InChI=1S/C22H29N3O2S/c1-4-15-27-20-13-9-18(10-14-20)21(26)24-22(28)23-19-11-7-17(8-12-19)16-25(5-2)6-3/h7-14H,4-6,15-16H2,1-3H3,(H2,23,24,26,28)