N-[[3-cyclohexyl-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]-3-fluoranyl-N-prop-2-enyl-benzamide

Systemtic Name: N-[[3-cyclohexyl-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]-3-fluoranyl-N-prop-2-enyl-benzamide Openeye Name: N-allyl-N-[(2-benzylsulfonyl-3-cyclohexyl-imidazol-4-yl)methyl]-3-fluoro-benzamide CAS Name: N-[[3-cyclohexyl-2-(phenylmethyl)sulfonyl-4-imidazolyl]methyl]-3-fluoro-N-prop-2-enylbenzamide IUPAC Name: N-[(2-benzylsulfonyl-3-cyclohexylimidazol-4-yl)methyl]-3-fluoro-N-prop-2-enylbenzamide Traditional Name: N-allyl-N-[(2-benzylsulfonyl-3-cyclohexyl-imidazol-4-yl)methyl]-3-fluoro-benzamide Formula: C27H30FN3O3S MolecularWeight: 495.608803

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CN=C(N1C2CCCCC2)S(=O)(=O)CC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C=CCN(CC1=CN=C(N1C2CCCCC2)S(=O)(=O)CC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C27H30FN3O3S/c1-2-16-30(26(32)22-12-9-13-23(28)17-22)19-25-18-29-27(31(25)24-14-7-4-8-15-24)35(33,34)20-21-10-5-3-6-11-21/h2-3,5-6,9-13,17-18,24H,1,4,7-8,14-16,19-20H2