N-[2-chloranyl-4-[[(1S)-cyclohex-3-en-1-yl]carbonylamino]phenyl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[2-chloranyl-4-[[(1S)-cyclohex-3-en-1-yl]carbonylamino]phenyl]-3-methylsulfonyl-benzamide Openeye Name: N-[2-chloro-4-[[(1S)-cyclohex-3-ene-1-carbonyl]amino]phenyl]-3-methylsulfonyl-benzamide CAS Name: N-[2-chloro-4-[[[(1S)-1-cyclohex-3-enyl]-oxomethyl]amino]phenyl]-3-methylsulfonylbenzamide IUPAC Name: N-[2-chloro-4-[[(1S)-cyclohex-3-ene-1-carbonyl]amino]phenyl]-3-methylsulfonylbenzamide Traditional Name: N-[2-chloro-4-[[(1S)-cyclohex-3-ene-1-carbonyl]amino]phenyl]-3-mesyl-benzamide Formula: C21H21ClN2O4S MolecularWeight: 432.92044

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)C3CCC=CC3)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)[C@H]3CCC=CC3)Cl

InChI

InChI=1S/C21H21ClN2O4S/c1-29(27,28)17-9-5-8-15(12-17)21(26)24-19-11-10-16(13-18(19)22)23-20(25)14-6-3-2-4-7-14/h2-3,5,8-14H,4,6-7H2,1H3,(H,23,25)(H,24,26)/t14-/m1/s1