N-[(4-carbamimidoylphenyl)methyl]-3,5-dimethyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-3,5-dimethyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[(4-carbamimidoylphenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-3,5-dimethyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[(4-carbamimidoylphenyl)methyl]-3,5-dimethylpyrazole-4-carboxamide Traditional Name: N-(4-amidinobenzyl)-1-benzyl-3,5-dimethyl-pyrazole-4-carboxamide Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NCC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)C(=O)NCC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H23N5O/c1-14-19(15(2)26(25-14)13-17-6-4-3-5-7-17)21(27)24-12-16-8-10-18(11-9-16)20(22)23/h3-11H,12-13H2,1-2H3,(H3,22,23)(H,24,27)