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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N4O3S/c1-16(2)20(26)23-13-12-17-8-10-19(11-9-17)29(27,28)25-15-14-24(21(25)22)18-6-4-3-5-7-18/h8-11,18,22H,1,3-7,12-15H2,2H3,(H,23,26)