4-methoxy-N-(5-piperidin-1-ylisoquinolin-8-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-methoxy-N-(5-piperidin-1-ylisoquinolin-8-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-methoxy-N-[5-(1-piperidyl)-8-isoquinolyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-methoxy-N-[5-(1-piperidinyl)-8-isoquinolinyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-methoxy-N-(5-piperidin-1-ylisoquinolin-8-yl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-methoxy-N-(5-piperidino-8-isoquinolyl)-3-pyrrolidinosulfonyl-benzamide Formula: C26H30N4O4S MolecularWeight: 494.6058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4)S(=O)(=O)N5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C26H30N4O4S/c1-34-24-10-7-19(17-25(24)35(32,33)30-15-5-6-16-30)26(31)28-22-8-9-23(29-13-3-2-4-14-29)20-11-12-27-18-21(20)22/h7-12,17-18H,2-6,13-16H2,1H3,(H,28,31)