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

Systemtic Name: phenyl-(8-pyrrolidin-1-ylcarbonyl-4-sulfanylidene-imidazo[5,1-d][1,2,3,5]tetrazin-3-yl)methanone Openeye Name: phenyl-[8-(pyrrolidine-1-carbonyl)-4-thioxo-imidazo[5,1-d][1,2,3,5]tetrazin-3-yl]methanone CAS Name: [8-[oxo(1-pyrrolidinyl)methyl]-4-sulfanylidene-3-imidazo[5,1-d][1,2,3,5]tetrazinyl]-phenylmethanone IUPAC Name: phenyl-[8-(pyrrolidine-1-carbonyl)-4-sulfanylideneimidazo[5,1-d][1,2,3,5]tetrazin-3-yl]methanone Traditional Name: phenyl-[8-(pyrrolidine-1-carbonyl)-4-thioxo-imidazo[5,1-d][1,2,3,5]tetrazin-3-yl]methanone Formula: C16H14N6O2S MolecularWeight: 354.38636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C3N=NN(C(=S)N3C=N2)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)C2=C3N=NN(C(=S)N3C=N2)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C16H14N6O2S/c23-14(11-6-2-1-3-7-11)22-16(25)21-10-17-12(13(21)18-19-22)15(24)20-8-4-5-9-20/h1-3,6-7,10H,4-5,8-9H2