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

Systemtic Name: N-[1-(phenylmethyl)pyrrolidin-3-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide CAS Name: N-[1-(phenylmethyl)-3-pyrrolidinyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2)C(=O)NC3CCN(C3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2)C(=O)NC3CCN(C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H26N2OS/c24-21(20-13-17-9-5-2-6-10-19(17)25-20)22-18-11-12-23(15-18)14-16-7-3-1-4-8-16/h1,3-4,7-8,13,18H,2,5-6,9-12,14-15H2,(H,22,24)