N-[(Z)-(3,3-dimethyl-5-oxidanylidene-cyclohexylidene)amino]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide

Systemtic Name: N-[(Z)-(3,3-dimethyl-5-oxidanylidene-cyclohexylidene)amino]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: N-[(Z)-(3,3-dimethyl-5-oxo-cyclohexylidene)amino]-3-(4-morpholinosulfonylphenyl)propanamide CAS Name: N-[(Z)-(3,3-dimethyl-5-oxocyclohexylidene)amino]-3-[4-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: N-[(Z)-(3,3-dimethyl-5-oxocyclohexylidene)amino]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: N-[(Z)-(5-keto-3,3-dimethyl-cyclohexylidene)amino]-3-(4-morpholinosulfonylphenyl)propionamide Formula: C21H29N3O5S MolecularWeight: 435.53706

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NNC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)CC(=O)C1)C

Isomeric SMILES

CC1(C/C(=N/NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)/CC(=O)C1)C

InChI

InChI=1S/C21H29N3O5S/c1-21(2)14-17(13-18(25)15-21)22-23-20(26)8-5-16-3-6-19(7-4-16)30(27,28)24-9-11-29-12-10-24/h3-4,6-7H,5,8-15H2,1-2H3,(H,23,26)/b22-17+