1-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)-3-[(E)-pyridin-3-ylmethylideneamino]thiourea

Systemtic Name: 1-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)-3-[(E)-pyridin-3-ylmethylideneamino]thiourea Openeye Name: 1-(2-morpholino-5-morpholinosulfonyl-phenyl)-3-[(E)-3-pyridylmethyleneamino]thiourea CAS Name: 1-[2-(4-morpholinyl)-5-(4-morpholinylsulfonyl)phenyl]-3-[(E)-3-pyridinylmethylideneamino]thiourea IUPAC Name: 1-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylphenyl)-3-[(E)-pyridin-3-ylmethylideneamino]thiourea Traditional Name: 1-(2-morpholino-5-morpholinosulfonyl-phenyl)-3-[(E)-3-pyridylmethyleneamino]thiourea Formula: C21H26N6O4S2 MolecularWeight: 490.59894

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)NN=CC4=CN=CC=C4

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=S)N/N=C/C4=CN=CC=C4

InChI

InChI=1S/C21H26N6O4S2/c28-33(29,27-8-12-31-13-9-27)18-3-4-20(26-6-10-30-11-7-26)19(14-18)24-21(32)25-23-16-17-2-1-5-22-15-17/h1-5,14-16H,6-13H2,(H2,24,25,32)/b23-16+