[(3S)-3-methylpiperidin-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone

Systemtic Name: [(3S)-3-methylpiperidin-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone Openeye Name: [(3S)-3-methyl-1-piperidyl]-(3-phenyl-2-thioxo-1H-imidazol-4-yl)methanone CAS Name: [(3S)-3-methyl-1-piperidinyl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone IUPAC Name: [(3S)-3-methylpiperidin-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone Traditional Name: [(3S)-3-methylpiperidino]-(3-phenyl-2-thioxo-4-imidazolin-4-yl)methanone Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)C2=CNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C16H19N3OS/c1-12-6-5-9-18(11-12)15(20)14-10-17-16(21)19(14)13-7-3-2-4-8-13/h2-4,7-8,10,12H,5-6,9,11H2,1H3,(H,17,21)/t12-/m0/s1