N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CNC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CNC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C19H23N3O3S2/c23-19(21-12-9-15-5-1-2-6-16(15)14-21)20-13-17-7-8-18(26-17)27(24,25)22-10-3-4-11-22/h1-2,5-8H,3-4,9-14H2,(H,20,23)