(Z)-N-[2-[4-(2-azanylidene-3-cyclohexyl-imidazolidin-1-yl)sulfonylphenyl]ethyl]but-2-enamide

Systemtic Name: (Z)-N-[2-[4-(2-azanylidene-3-cyclohexyl-imidazolidin-1-yl)sulfonylphenyl]ethyl]but-2-enamide Openeye Name: (Z)-N-[2-[4-(3-cyclohexyl-2-imino-imidazolidin-1-yl)sulfonylphenyl]ethyl]but-2-enamide CAS Name: (Z)-N-[2-[4-[(3-cyclohexyl-2-imino-1-imidazolidinyl)sulfonyl]phenyl]ethyl]-2-butenamide IUPAC Name: (Z)-N-[2-[4-(3-cyclohexyl-2-iminoimidazolidin-1-yl)sulfonylphenyl]ethyl]but-2-enamide Traditional Name: (Z)-N-[2-[4-(3-cyclohexyl-2-imino-imidazolidin-1-yl)sulfonylphenyl]ethyl]but-2-enamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(C2=N)C3CCCCC3

Isomeric SMILES

C/C=C\C(=O)NCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(C2=N)C3CCCCC3

InChI

InChI=1S/C21H30N4O3S/c1-2-6-20(26)23-14-13-17-9-11-19(12-10-17)29(27,28)25-16-15-24(21(25)22)18-7-4-3-5-8-18/h2,6,9-12,18,22H,3-5,7-8,13-16H2,1H3,(H,23,26)/b6-2-,22-21?