N-carbamimidoyl-N-(2-cyclohexylethanoyl)-3-methylsulfonyl-benzamide hydrochloride

Systemtic Name: N-carbamimidoyl-N-(2-cyclohexylethanoyl)-3-methylsulfonyl-benzamide hydrochloride Openeye Name: N-carbamimidoyl-N-(2-cyclohexylacetyl)-3-methylsulfonyl-benzamide hydrochloride CAS Name: N-carbamimidoyl-N-(2-cyclohexyl-1-oxoethyl)-3-methylsulfonylbenzamide hydrochloride IUPAC Name: N-carbamimidoyl-N-(2-cyclohexylacetyl)-3-methylsulfonylbenzamide hydrochloride Traditional Name: N-amidino-N-(2-cyclohexylacetyl)-3-mesyl-benzamide hydrochloride Formula: C17H24ClN3O4S MolecularWeight: 401.90816

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N(C(=O)CC2CCCCC2)C(=N)N.Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N(C(=O)CC2CCCCC2)C(=N)N.Cl

InChI

InChI=1S/C17H23N3O4S.ClH/c1-25(23,24)14-9-5-8-13(11-14)16(22)20(17(18)19)15(21)10-12-6-3-2-4-7-12;/h5,8-9,11-12H,2-4,6-7,10H2,1H3,(H3,18,19);1H