2-(3-carbamimidoylphenyl)-N-[4-(dimethylcarbamoylamino)phenyl]-5-methyl-pyrazole-3-carboxamide

Systemtic Name: 2-(3-carbamimidoylphenyl)-N-[4-(dimethylcarbamoylamino)phenyl]-5-methyl-pyrazole-3-carboxamide Openeye Name: 2-(3-carbamimidoylphenyl)-N-[4-(dimethylcarbamoylamino)phenyl]-5-methyl-pyrazole-3-carboxamide CAS Name: 2-(3-carbamimidoylphenyl)-N-[4-[[dimethylamino(oxo)methyl]amino]phenyl]-5-methyl-3-pyrazolecarboxamide IUPAC Name: 2-(3-carbamimidoylphenyl)-N-[4-(dimethylcarbamoylamino)phenyl]-5-methylpyrazole-3-carboxamide Traditional Name: 2-(3-amidinophenyl)-N-[4-(dimethylcarbamoylamino)phenyl]-5-methyl-pyrazole-3-carboxamide Formula: C21H23N7O2 MolecularWeight: 405.45302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)NC(=O)N(C)C)C3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)NC(=O)N(C)C)C3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C21H23N7O2/c1-13-11-18(28(26-13)17-6-4-5-14(12-17)19(22)23)20(29)24-15-7-9-16(10-8-15)25-21(30)27(2)3/h4-12H,1-3H3,(H3,22,23)(H,24,29)(H,25,30)