1-isoquinolin-5-yl-3-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-isoquinolin-5-yl-3-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(5-isoquinolyl)-3-(2-morpholino-5-morpholinosulfonyl-phenyl)thiourea CAS Name: 1-(5-isoquinolinyl)-3-[2-(4-morpholinyl)-5-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-isoquinolin-5-yl-3-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-(5-isoquinolyl)-3-(2-morpholino-5-morpholinosulfonyl-phenyl)thiourea Formula: C24H27N5O4S2 MolecularWeight: 513.63228

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)NC4=CC=CC5=C4C=CN=C5

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)NC4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C24H27N5O4S2/c30-35(31,29-10-14-33-15-11-29)19-4-5-23(28-8-12-32-13-9-28)22(16-19)27-24(34)26-21-3-1-2-18-17-25-7-6-20(18)21/h1-7,16-17H,8-15H2,(H2,26,27,34)