[4-(2-methoxyphenyl)piperazin-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone

Systemtic Name: [4-(2-methoxyphenyl)piperazin-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone Openeye Name: [4-(2-methoxyphenyl)piperazin-1-yl]-(3-phenyl-2-thioxo-1H-imidazol-4-yl)methanone CAS Name: [4-(2-methoxyphenyl)-1-piperazinyl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone IUPAC Name: [4-(2-methoxyphenyl)piperazin-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone Traditional Name: [4-(2-methoxyphenyl)piperazino]-(3-phenyl-2-thioxo-4-imidazolin-4-yl)methanone Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CNC(=S)N3C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CNC(=S)N3C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2S/c1-27-19-10-6-5-9-17(19)23-11-13-24(14-12-23)20(26)18-15-22-21(28)25(18)16-7-3-2-4-8-16/h2-10,15H,11-14H2,1H3,(H,22,28)