N-(2-adamantylideneamino)-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(2-adamantylideneamino)-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(2-adamantylideneamino)-3-morpholinosulfonyl-benzamide CAS Name: N-(2-adamantylideneamino)-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(2-adamantylideneamino)-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(2-adamantylideneamino)-3-morpholinosulfonyl-benzamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NN=C3C4CC5CC(C4)CC3C5

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NN=C3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C21H27N3O4S/c25-21(23-22-20-17-9-14-8-15(11-17)12-18(20)10-14)16-2-1-3-19(13-16)29(26,27)24-4-6-28-7-5-24/h1-3,13-15,17-18H,4-12H2,(H,23,25)