(3S)-1-(4-bromanyl-1-methoxy-isoquinolin-5-yl)sulfonylpyrrolidin-3-amine

Systemtic Name: (3S)-1-(4-bromanyl-1-methoxy-isoquinolin-5-yl)sulfonylpyrrolidin-3-amine Openeye Name: (3S)-1-[(4-bromo-1-methoxy-5-isoquinolyl)sulfonyl]pyrrolidin-3-amine CAS Name: (3S)-1-[(4-bromo-1-methoxy-5-isoquinolinyl)sulfonyl]-3-pyrrolidinamine IUPAC Name: (3S)-1-(4-bromo-1-methoxyisoquinolin-5-yl)sulfonylpyrrolidin-3-amine Traditional Name: [(3S)-1-[(4-bromo-1-methoxy-5-isoquinolyl)sulfonyl]pyrrolidin-3-yl]amine Formula: C14H16BrN3O3S MolecularWeight: 386.26414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C2=C1C=CC=C2S(=O)(=O)N3CCC(C3)N)Br

Isomeric SMILES

COC1=NC=C(C2=C1C=CC=C2S(=O)(=O)N3CC[C@@H](C3)N)Br

InChI

InChI=1S/C14H16BrN3O3S/c1-21-14-10-3-2-4-12(13(10)11(15)7-17-14)22(19,20)18-6-5-9(16)8-18/h2-4,7,9H,5-6,8,16H2,1H3/t9-/m0/s1