3-[(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-3-(4-methylpiperidin-1-yl)-3-oxidanylidene-propyl]benzenecarboximidamide

Systemtic Name: 3-[(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-3-(4-methylpiperidin-1-yl)-3-oxidanylidene-propyl]benzenecarboximidamide Openeye Name: 3-[(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-3-(4-methyl-1-piperidyl)-3-oxo-propyl]benzamidine CAS Name: 3-[(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-3-(4-methyl-1-piperidinyl)-3-oxopropyl]benzenecarboximidamide IUPAC Name: 3-[(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzenecarboximidamide Traditional Name: 3-[(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-3-keto-3-(4-methylpiperidino)propyl]benzamidine Formula: C26H36N4O3S MolecularWeight: 484.65404

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(CC2=CC=CC(=C2)C(=N)N)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1CCN(CC1)C(=O)[C@H](CC2=CC=CC(=C2)C(=N)N)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H36N4O3S/c1-18-12-14-30(15-13-18)25(31)23(17-19-6-5-7-20(16-19)24(27)28)29-34(32,33)22-10-8-21(9-11-22)26(2,3)4/h5-11,16,18,23,29H,12-15,17H2,1-4H3,(H3,27,28)/t23-/m0/s1