N-(3-imidazol-1-ylpropyl)-5-[1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]thiophene-2-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-5-[1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]thiophene-2-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-5-[1-(4-pyridylmethyl)pyrrolidin-2-yl]thiophene-2-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-5-[1-(pyridin-4-ylmethyl)-2-pyrrolidinyl]-2-thiophenecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-5-[1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]thiophene-2-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-5-[1-(4-pyridylmethyl)pyrrolidin-2-yl]thiophene-2-carboxamide Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CC2=CC=NC=C2)C3=CC=C(S3)C(=O)NCCCN4C=CN=C4

Isomeric SMILES

C1CC(N(C1)CC2=CC=NC=C2)C3=CC=C(S3)C(=O)NCCCN4C=CN=C4

InChI

InChI=1S/C21H25N5OS/c27-21(24-8-2-12-25-14-11-23-16-25)20-5-4-19(28-20)18-3-1-13-26(18)15-17-6-9-22-10-7-17/h4-7,9-11,14,16,18H,1-3,8,12-13,15H2,(H,24,27)