phenyl-(8-piperidin-1-ylcarbonyl-4-sulfanylidene-imidazo[5,1-d][1,2,3,5]tetrazin-3-yl)methanone

Systemtic Name: phenyl-(8-piperidin-1-ylcarbonyl-4-sulfanylidene-imidazo[5,1-d][1,2,3,5]tetrazin-3-yl)methanone Openeye Name: phenyl-[8-(piperidine-1-carbonyl)-4-thioxo-imidazo[5,1-d][1,2,3,5]tetrazin-3-yl]methanone CAS Name: [8-[oxo(1-piperidinyl)methyl]-4-sulfanylidene-3-imidazo[5,1-d][1,2,3,5]tetrazinyl]-phenylmethanone IUPAC Name: phenyl-[8-(piperidine-1-carbonyl)-4-sulfanylideneimidazo[5,1-d][1,2,3,5]tetrazin-3-yl]methanone Traditional Name: phenyl-[8-(piperidine-1-carbonyl)-4-thioxo-imidazo[5,1-d][1,2,3,5]tetrazin-3-yl]methanone Formula: C17H16N6O2S MolecularWeight: 368.41294

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C3N=NN(C(=S)N3C=N2)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C3N=NN(C(=S)N3C=N2)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C17H16N6O2S/c24-15(12-7-3-1-4-8-12)23-17(26)22-11-18-13(14(22)19-20-23)16(25)21-9-5-2-6-10-21/h1,3-4,7-8,11H,2,5-6,9-10H2