3-bromanyl-4-ethoxy-N-(4-methylpiperazin-1-yl)carbothioyl-benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-(4-methylpiperazin-1-yl)carbothioyl-benzamide Openeye Name: 3-bromo-4-ethoxy-N-(4-methylpiperazine-1-carbothioyl)benzamide CAS Name: 3-bromo-4-ethoxy-N-[(4-methyl-1-piperazinyl)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-(4-methylpiperazine-1-carbothioyl)benzamide Traditional Name: 3-bromo-4-ethoxy-N-(4-methylpiperazine-1-carbothioyl)benzamide Formula: C15H20BrN3O2S MolecularWeight: 386.3072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)N2CCN(CC2)C)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)N2CCN(CC2)C)Br

InChI

InChI=1S/C15H20BrN3O2S/c1-3-21-13-5-4-11(10-12(13)16)14(20)17-15(22)19-8-6-18(2)7-9-19/h4-5,10H,3,6-9H2,1-2H3,(H,17,20,22)