N-(4-phenylpiperazin-1-yl)carbothioyl-3-propoxy-benzamide

Systemtic Name: N-(4-phenylpiperazin-1-yl)carbothioyl-3-propoxy-benzamide Openeye Name: N-(4-phenylpiperazine-1-carbothioyl)-3-propoxy-benzamide CAS Name: N-[(4-phenyl-1-piperazinyl)-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-(4-phenylpiperazine-1-carbothioyl)-3-propoxybenzamide Traditional Name: N-(4-phenylpiperazine-1-carbothioyl)-3-propoxy-benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2S/c1-2-15-26-19-10-6-7-17(16-19)20(25)22-21(27)24-13-11-23(12-14-24)18-8-4-3-5-9-18/h3-10,16H,2,11-15H2,1H3,(H,22,25,27)