2-azanyl-4-(3-methoxyphenyl)-8-sulfanylidene-3a,4,5,7-tetrahydropyrano[2,3-e]benzimidazole-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-methoxyphenyl)-8-sulfanylidene-3a,4,5,7-tetrahydropyrano[2,3-e]benzimidazole-3-carbonitrile Openeye Name: 2-amino-4-(3-methoxyphenyl)-8-thioxo-3a,4,5,7-tetrahydropyrano[2,3-e]benzimidazole-3-carbonitrile CAS Name: 2-amino-4-(3-methoxyphenyl)-8-sulfanylidene-3a,4,5,7-tetrahydropyrano[2,3-e]benzimidazole-3-carbonitrile IUPAC Name: 2-amino-4-(3-methoxyphenyl)-8-sulfanylidene-3a,4,5,7-tetrahydropyrano[2,3-e]benzimidazole-3-carbonitrile Traditional Name: 2-amino-4-(3-methoxyphenyl)-8-thioxo-3a,4,5,7-tetrahydropyrano[2,3-e]benzimidazole-3-carbonitrile Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CC3=CCC(=S)OC3=C4C2N(C(=N4)N)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C2CC3=CCC(=S)OC3=C4C2N(C(=N4)N)C#N

InChI

InChI=1S/C18H16N4O2S/c1-23-12-4-2-3-10(7-12)13-8-11-5-6-14(25)24-17(11)15-16(13)22(9-19)18(20)21-15/h2-5,7,13,16H,6,8H2,1H3,(H2,20,21)