3-methyl-N-[[4-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[[4-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl]butanamide Openeye Name: 3-methyl-N-[[4-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl]butanamide CAS Name: 3-methyl-N-[[4-[4-(1-oxopropyl)-1-piperazinyl]anilino]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[[4-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl]butanamide Traditional Name: 3-methyl-N-[[4-(4-propionylpiperazino)phenyl]thiocarbamoyl]butyramide Formula: C19H28N4O2S MolecularWeight: 376.51622

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)CC(C)C

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)CC(C)C

InChI

InChI=1S/C19H28N4O2S/c1-4-18(25)23-11-9-22(10-12-23)16-7-5-15(6-8-16)20-19(26)21-17(24)13-14(2)3/h5-8,14H,4,9-13H2,1-3H3,(H2,20,21,24,26)