5-chloranyl-N-[1-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbonyl]pyrrolidin-3-yl]thiophene-2-carboxamide

Systemtic Name: 5-chloranyl-N-[1-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbonyl]pyrrolidin-3-yl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[1-(2-methyl-3,4-dihydro-1H-isoquinoline-7-carbonyl)pyrrolidin-3-yl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[1-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-oxomethyl]-3-pyrrolidinyl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[1-(2-methyl-3,4-dihydro-1H-isoquinoline-7-carbonyl)pyrrolidin-3-yl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[1-(2-methyl-3,4-dihydro-1H-isoquinoline-7-carbonyl)pyrrolidin-3-yl]thiophene-2-carboxamide Formula: C20H22ClN3O2S MolecularWeight: 403.92558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C=C(C=C2)C(=O)N3CCC(C3)NC(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CN1CCC2=C(C1)C=C(C=C2)C(=O)N3CCC(C3)NC(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C20H22ClN3O2S/c1-23-8-6-13-2-3-14(10-15(13)11-23)20(26)24-9-7-16(12-24)22-19(25)17-4-5-18(21)27-17/h2-5,10,16H,6-9,11-12H2,1H3,(H,22,25)