N-carbamimidoyl-N-(2-chloranyl-4-methylsulfonyl-phenyl)-5-cyclopropyl-1H-pyrazole-4-carboxamide

Systemtic Name: N-carbamimidoyl-N-(2-chloranyl-4-methylsulfonyl-phenyl)-5-cyclopropyl-1H-pyrazole-4-carboxamide Openeye Name: N-carbamimidoyl-N-(2-chloro-4-methylsulfonyl-phenyl)-5-cyclopropyl-1H-pyrazole-4-carboxamide CAS Name: N-carbamimidoyl-N-(2-chloro-4-methylsulfonylphenyl)-5-cyclopropyl-1H-pyrazole-4-carboxamide IUPAC Name: N-carbamimidoyl-N-(2-chloro-4-methylsulfonylphenyl)-5-cyclopropyl-1H-pyrazole-4-carboxamide Traditional Name: N-amidino-N-(2-chloro-4-mesyl-phenyl)-5-cyclopropyl-1H-pyrazole-4-carboxamide Formula: C15H16ClN5O3S MolecularWeight: 381.83724

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N(C(=O)C2=C(NN=C2)C3CC3)C(=N)N)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N(C(=O)C2=C(NN=C2)C3CC3)C(=N)N)Cl

InChI

InChI=1S/C15H16ClN5O3S/c1-25(23,24)9-4-5-12(11(16)6-9)21(15(17)18)14(22)10-7-19-20-13(10)8-2-3-8/h4-8H,2-3H2,1H3,(H3,17,18)(H,19,20)