(2E)-4,6-bis(azanyl)-2-[4-methyl-3-(phenylcarbonyl)-2-sulfanylidene-imidazol-1-yl]imino-pyran-3-carbonitrile

Systemtic Name: (2E)-4,6-bis(azanyl)-2-[4-methyl-3-(phenylcarbonyl)-2-sulfanylidene-imidazol-1-yl]imino-pyran-3-carbonitrile Openeye Name: (2E)-4,6-diamino-2-(3-benzoyl-4-methyl-2-thioxo-imidazol-1-yl)imino-pyran-3-carbonitrile CAS Name: (2E)-4,6-diamino-2-[(3-benzoyl-4-methyl-2-sulfanylidene-1-imidazolyl)imino]-3-pyrancarbonitrile IUPAC Name: (2E)-4,6-diamino-2-(3-benzoyl-4-methyl-2-sulfanylideneimidazol-1-yl)iminopyran-3-carbonitrile Traditional Name: (2E)-4,6-diamino-2-[(3-benzoyl-4-methyl-2-thioxo-4-imidazolin-1-yl)imino]pyran-3-carbonitrile Formula: C17H14N6O2S MolecularWeight: 366.39706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=S)N1C(=O)C2=CC=CC=C2)N=C3C(=C(C=C(O3)N)N)C#N

Isomeric SMILES

CC1=CN(C(=S)N1C(=O)C2=CC=CC=C2)/N=C/3\C(=C(C=C(O3)N)N)C#N

InChI

InChI=1S/C17H14N6O2S/c1-10-9-22(21-15-12(8-18)13(19)7-14(20)25-15)17(26)23(10)16(24)11-5-3-2-4-6-11/h2-7,9H,19-20H2,1H3/b21-15+