N-[1-(3-azanylpropyl)-5-(cyclohexylcarbonylamino)benzimidazol-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-(3-azanylpropyl)-5-(cyclohexylcarbonylamino)benzimidazol-2-yl]thiophene-2-carboxamide Openeye Name: N-[1-(3-aminopropyl)-5-(cyclohexanecarbonylamino)benzimidazol-2-yl]thiophene-2-carboxamide CAS Name: N-[1-(3-aminopropyl)-5-[[cyclohexyl(oxo)methyl]amino]-2-benzimidazolyl]-2-thiophenecarboxamide IUPAC Name: N-[1-(3-aminopropyl)-5-(cyclohexanecarbonylamino)benzimidazol-2-yl]thiophene-2-carboxamide Traditional Name: N-[1-(3-aminopropyl)-5-(cyclohexanecarbonylamino)benzimidazol-2-yl]thiophene-2-carboxamide Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC3=C(C=C2)N(C(=N3)NC(=O)C4=CC=CS4)CCCN

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC3=C(C=C2)N(C(=N3)NC(=O)C4=CC=CS4)CCCN

InChI

InChI=1S/C22H27N5O2S/c23-11-5-12-27-18-10-9-16(24-20(28)15-6-2-1-3-7-15)14-17(18)25-22(27)26-21(29)19-8-4-13-30-19/h4,8-10,13-15H,1-3,5-7,11-12,23H2,(H,24,28)(H,25,26,29)