(2S,3R)-5-azanyl-3-(furan-2-yl)-2-(1-methylbenzimidazol-2-yl)carbonyl-2,3-dihydrothiophene-4-carbonitrile

Systemtic Name: (2S,3R)-5-azanyl-3-(furan-2-yl)-2-(1-methylbenzimidazol-2-yl)carbonyl-2,3-dihydrothiophene-4-carbonitrile Openeye Name: (2S,3R)-5-amino-3-(2-furyl)-2-(1-methylbenzimidazole-2-carbonyl)-2,3-dihydrothiophene-4-carbonitrile CAS Name: (2S,3R)-5-amino-3-(2-furanyl)-2-[(1-methyl-2-benzimidazolyl)-oxomethyl]-2,3-dihydrothiophene-4-carbonitrile IUPAC Name: (2S,3R)-5-amino-3-(furan-2-yl)-2-(1-methylbenzimidazole-2-carbonyl)-2,3-dihydrothiophene-4-carbonitrile Traditional Name: (2S,3R)-5-amino-3-(2-furyl)-2-(1-methylbenzimidazole-2-carbonyl)-2,3-dihydrothiophene-4-carbonitrile Formula: C18H14N4O2S MolecularWeight: 350.39436

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(=O)C3C(C(=C(S3)N)C#N)C4=CC=CO4

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C(=O)[C@@H]3[C@H](C(=C(S3)N)C#N)C4=CC=CO4

InChI

InChI=1S/C18H14N4O2S/c1-22-12-6-3-2-5-11(12)21-18(22)15(23)16-14(13-7-4-8-24-13)10(9-19)17(20)25-16/h2-8,14,16H,20H2,1H3/t14-,16+/m1/s1