4-(2-methylpiperidin-1-yl)sulfonyl-N-(5-morpholin-4-ylisoquinolin-8-yl)benzamide

Systemtic Name: 4-(2-methylpiperidin-1-yl)sulfonyl-N-(5-morpholin-4-ylisoquinolin-8-yl)benzamide Openeye Name: 4-[(2-methyl-1-piperidyl)sulfonyl]-N-(5-morpholino-8-isoquinolyl)benzamide CAS Name: 4-[(2-methyl-1-piperidinyl)sulfonyl]-N-[5-(4-morpholinyl)-8-isoquinolinyl]benzamide IUPAC Name: 4-(2-methylpiperidin-1-yl)sulfonyl-N-(5-morpholin-4-ylisoquinolin-8-yl)benzamide Traditional Name: 4-(2-methylpiperidino)sulfonyl-N-(5-morpholino-8-isoquinolyl)benzamide Formula: C26H30N4O4S MolecularWeight: 494.6058

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C4C=NC=CC4=C(C=C3)N5CCOCC5

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C4C=NC=CC4=C(C=C3)N5CCOCC5

InChI

InChI=1S/C26H30N4O4S/c1-19-4-2-3-13-30(19)35(32,33)21-7-5-20(6-8-21)26(31)28-24-9-10-25(29-14-16-34-17-15-29)22-11-12-27-18-23(22)24/h5-12,18-19H,2-4,13-17H2,1H3,(H,28,31)