3-[2-[[(1R,4S)-7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl]methylsulfonylamino]-3-(4-methylsulfonylpiperazin-1-yl)-3-oxidanylidene-propyl]benzenecarboximidamide

Systemtic Name: 3-[2-[[(1R,4S)-7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl]methylsulfonylamino]-3-(4-methylsulfonylpiperazin-1-yl)-3-oxidanylidene-propyl]benzenecarboximidamide Openeye Name: 3-[2-[[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]methylsulfonylamino]-3-(4-methylsulfonylpiperazin-1-yl)-3-oxo-propyl]benzamidine CAS Name: 3-[2-[[(1R,4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methylsulfonylamino]-3-(4-methylsulfonyl-1-piperazinyl)-3-oxopropyl]benzenecarboximidamide IUPAC Name: 3-[2-[[(1R,4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methylsulfonylamino]-3-(4-methylsulfonylpiperazin-1-yl)-3-oxopropyl]benzenecarboximidamide Traditional Name: 3-[3-keto-2-[[(1S,4R)-2-keto-7,7-dimethyl-norbornan-1-yl]methylsulfonylamino]-3-(4-mesylpiperazino)propyl]benzamidine Formula: C25H37N5O6S2 MolecularWeight: 567.72118

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(=O)C2)CS(=O)(=O)NC(CC3=CC=CC(=C3)C(=N)N)C(=O)N4CCN(CC4)S(=O)(=O)C)C

Isomeric SMILES

CC1([C@@H]2CC[C@]1(C(=O)C2)CS(=O)(=O)NC(CC3=CC=CC(=C3)C(=N)N)C(=O)N4CCN(CC4)S(=O)(=O)C)C

InChI

InChI=1S/C25H37N5O6S2/c1-24(2)19-7-8-25(24,21(31)15-19)16-38(35,36)28-20(14-17-5-4-6-18(13-17)22(26)27)23(32)29-9-11-30(12-10-29)37(3,33)34/h4-6,13,19-20,28H,7-12,14-16H2,1-3H3,(H3,26,27)/t19-,20?,25-/m1/s1