1-ethyl-3-[3-(4-methylsulfanylpiperazin-1-yl)carbonyl-1-benzothiophen-2-yl]urea

Systemtic Name: 1-ethyl-3-[3-(4-methylsulfanylpiperazin-1-yl)carbonyl-1-benzothiophen-2-yl]urea Openeye Name: 1-ethyl-3-[3-(4-methylsulfanylpiperazine-1-carbonyl)benzothiophen-2-yl]urea CAS Name: 1-ethyl-3-[3-[[4-(methylthio)-1-piperazinyl]-oxomethyl]-1-benzothiophen-2-yl]urea IUPAC Name: 1-ethyl-3-[3-(4-methylsulfanylpiperazine-1-carbonyl)-1-benzothiophen-2-yl]urea Traditional Name: 1-ethyl-3-[3-[4-(methylthio)piperazine-1-carbonyl]benzothiophen-2-yl]urea Formula: C17H22N4O2S2 MolecularWeight: 378.51218

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=C(C2=CC=CC=C2S1)C(=O)N3CCN(CC3)SC

Isomeric SMILES

CCNC(=O)NC1=C(C2=CC=CC=C2S1)C(=O)N3CCN(CC3)SC

InChI

InChI=1S/C17H22N4O2S2/c1-3-18-17(23)19-15-14(12-6-4-5-7-13(12)25-15)16(22)20-8-10-21(24-2)11-9-20/h4-7H,3,8-11H2,1-2H3,(H2,18,19,23)