2-(1-methylimidazol-4-yl)sulfonyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-isoquinolin-6-ol

Systemtic Name: 2-(1-methylimidazol-4-yl)sulfonyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-isoquinolin-6-ol Openeye Name: 2-(1-methylimidazol-4-yl)sulfonyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-isoquinolin-6-ol CAS Name: 2-[(1-methyl-4-imidazolyl)sulfonyl]-1-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-3,4-dihydro-1H-isoquinolin-6-ol IUPAC Name: 2-(1-methylimidazol-4-yl)sulfonyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-isoquinolin-6-ol Traditional Name: 2-(1-methylimidazol-4-yl)sulfonyl-1-[4-(2-pyrrolidinoethoxy)phenyl]-3,4-dihydro-1H-isoquinolin-6-ol Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)S(=O)(=O)N2CCC3=C(C2C4=CC=C(C=C4)OCCN5CCCC5)C=CC(=C3)O

Isomeric SMILES

CN1C=C(N=C1)S(=O)(=O)N2CCC3=C(C2C4=CC=C(C=C4)OCCN5CCCC5)C=CC(=C3)O

InChI

InChI=1S/C25H30N4O4S/c1-27-17-24(26-18-27)34(31,32)29-13-10-20-16-21(30)6-9-23(20)25(29)19-4-7-22(8-5-19)33-15-14-28-11-2-3-12-28/h4-9,16-18,25,30H,2-3,10-15H2,1H3