2-methyl-1-[4-[(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)carbonyl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-[(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)carbonyl]piperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-(3-phenyl-2-thioxo-1H-imidazole-4-carbonyl)piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[oxo-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-(3-phenyl-2-sulfanylidene-1H-imidazole-4-carbonyl)piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-(3-phenyl-2-thioxo-4-imidazoline-4-carbonyl)piperazino]propan-1-one Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C18H22N4O2S/c1-13(2)16(23)20-8-10-21(11-9-20)17(24)15-12-19-18(25)22(15)14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3,(H,19,25)