2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-morpholino-5-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-[2-(4-morpholinyl)-5-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(2-morpholino-5-morpholinosulfonyl-phenyl)acetamide Formula: C25H30N6O5S3 MolecularWeight: 590.7379

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N5CCOCC5)C6=CC=CS6

Isomeric SMILES

C1CC1N2C(=NN=C2SCC(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N5CCOCC5)C6=CC=CS6

InChI

InChI=1S/C25H30N6O5S3/c32-23(17-38-25-28-27-24(22-2-1-15-37-22)31(25)18-3-4-18)26-20-16-19(39(33,34)30-9-13-36-14-10-30)5-6-21(20)29-7-11-35-12-8-29/h1-2,5-6,15-16,18H,3-4,7-14,17H2,(H,26,32)