N-[1-(3-azanyl-3-oxidanylidene-propyl)-5-(1-cyclopropyl-1-oxidanylidene-propan-2-yl)benzimidazol-2-yl]-5-cyano-thiophene-2-carboxamide

Systemtic Name: N-[1-(3-azanyl-3-oxidanylidene-propyl)-5-(1-cyclopropyl-1-oxidanylidene-propan-2-yl)benzimidazol-2-yl]-5-cyano-thiophene-2-carboxamide Openeye Name: N-[1-(3-amino-3-oxo-propyl)-5-(2-cyclopropyl-1-methyl-2-oxo-ethyl)benzimidazol-2-yl]-5-cyano-thiophene-2-carboxamide CAS Name: N-[1-(3-amino-3-oxopropyl)-5-(1-cyclopropyl-1-oxopropan-2-yl)-2-benzimidazolyl]-5-cyano-2-thiophenecarboxamide IUPAC Name: N-[1-(3-amino-3-oxopropyl)-5-(1-cyclopropyl-1-oxopropan-2-yl)benzimidazol-2-yl]-5-cyanothiophene-2-carboxamide Traditional Name: N-[1-(3-amino-3-keto-propyl)-5-(2-cyclopropyl-2-keto-1-methyl-ethyl)benzimidazol-2-yl]-5-cyano-thiophene-2-carboxamide Formula: C22H21N5O3S MolecularWeight: 435.49884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)N(C(=N2)NC(=O)C3=CC=C(S3)C#N)CCC(=O)N)C(=O)C4CC4

Isomeric SMILES

CC(C1=CC2=C(C=C1)N(C(=N2)NC(=O)C3=CC=C(S3)C#N)CCC(=O)N)C(=O)C4CC4

InChI

InChI=1S/C22H21N5O3S/c1-12(20(29)13-2-3-13)14-4-6-17-16(10-14)25-22(27(17)9-8-19(24)28)26-21(30)18-7-5-15(11-23)31-18/h4-7,10,12-13H,2-3,8-9H2,1H3,(H2,24,28)(H,25,26,30)