N-[2-[4-(2-azanylidene-3-cyclohex-3-en-1-yl-imidazolidin-1-yl)sulfonylphenyl]ethyl]butanamide

Systemtic Name: N-[2-[4-(2-azanylidene-3-cyclohex-3-en-1-yl-imidazolidin-1-yl)sulfonylphenyl]ethyl]butanamide Openeye Name: N-[2-[4-(3-cyclohex-3-en-1-yl-2-imino-imidazolidin-1-yl)sulfonylphenyl]ethyl]butanamide CAS Name: N-[2-[4-[[3-(1-cyclohex-3-enyl)-2-imino-1-imidazolidinyl]sulfonyl]phenyl]ethyl]butanamide IUPAC Name: N-[2-[4-(3-cyclohex-3-en-1-yl-2-iminoimidazolidin-1-yl)sulfonylphenyl]ethyl]butanamide Traditional Name: N-[2-[4-(3-cyclohex-3-en-1-yl-2-imino-imidazolidin-1-yl)sulfonylphenyl]ethyl]butyramide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(C2=N)C3CCC=CC3

Isomeric SMILES

CCCC(=O)NCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(C2=N)C3CCC=CC3

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/h3-4,9-12,18,22H,2,5-8,13-16H2,1H3,(H,23,26)