4-(cyclohexylcarbamoylamino)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]butanamide

Systemtic Name: 4-(cyclohexylcarbamoylamino)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]butanamide Openeye Name: 4-(cyclohexylcarbamoylamino)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]butanamide CAS Name: 4-[[(cyclohexylamino)-oxomethyl]amino]-N-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylphenyl]butanamide IUPAC Name: 4-(cyclohexylcarbamoylamino)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]butanamide Traditional Name: 4-(cyclohexylcarbamoylamino)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]butyramide Formula: C24H40N5O2+ MolecularWeight: 430.6067

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CCCNC(=O)NC3CCCCC3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CCCNC(=O)NC3CCCCC3)C

InChI

InChI=1S/C24H39N5O2/c1-3-28-14-16-29(17-15-28)21-11-12-22(19(2)18-21)27-23(30)10-7-13-25-24(31)26-20-8-5-4-6-9-20/h11-12,18,20H,3-10,13-17H2,1-2H3,(H,27,30)(H2,25,26,31)/p+1