(E)-N-[2-[4-(2-azanylidene-3-cyclohexyl-imidazolidin-1-yl)sulfonylphenyl]ethyl]but-2-en-1-amine; methanol

Systemtic Name: (E)-N-[2-[4-(2-azanylidene-3-cyclohexyl-imidazolidin-1-yl)sulfonylphenyl]ethyl]but-2-en-1-amine; methanol Openeye Name: (E)-N-[2-[4-(3-cyclohexyl-2-imino-imidazolidin-1-yl)sulfonylphenyl]ethyl]but-2-en-1-amine; methanol CAS Name: (E)-N-[2-[4-[(3-cyclohexyl-2-imino-1-imidazolidinyl)sulfonyl]phenyl]ethyl]-2-buten-1-amine; methanol IUPAC Name: (E)-N-[2-[4-(3-cyclohexyl-2-iminoimidazolidin-1-yl)sulfonylphenyl]ethyl]but-2-en-1-amine; methanol Traditional Name: [(E)-but-2-enyl]-[2-[4-(3-cyclohexyl-2-imino-imidazolidin-1-yl)sulfonylphenyl]ethyl]amine; methanol Formula: C22H36N4O3S MolecularWeight: 436.61124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CCNCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(C2=N)C3CCCCC3.CO

Isomeric SMILES

C/C=C/CNCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(C2=N)C3CCCCC3.CO

InChI

InChI=1S/C21H32N4O2S.CH4O/c1-2-3-14-23-15-13-18-9-11-20(12-10-18)28(26,27)25-17-16-24(21(25)22)19-7-5-4-6-8-19;1-2/h2-3,9-12,19,22-23H,4-8,13-17H2,1H3;2H,1H3/b3-2+,22-21?;