N-[3-(benzimidazol-1-yl)propyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide CAS Name: N-[3-(1-benzimidazolyl)propyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide Traditional Name: N-[3-(benzimidazol-1-yl)propyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2)C(=O)NCCCN3C=NC4=CC=CC=C43

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2)C(=O)NCCCN3C=NC4=CC=CC=C43

InChI

InChI=1S/C20H23N3OS/c24-20(19-13-15-7-2-1-3-10-18(15)25-19)21-11-6-12-23-14-22-16-8-4-5-9-17(16)23/h4-5,8-9,13-14H,1-3,6-7,10-12H2,(H,21,24)