2-(3-carbamimidoylphenyl)-5-methyl-N-(3-phenylpropyl)pyrazole-3-carboxamide

Systemtic Name: 2-(3-carbamimidoylphenyl)-5-methyl-N-(3-phenylpropyl)pyrazole-3-carboxamide Openeye Name: 2-(3-carbamimidoylphenyl)-5-methyl-N-(3-phenylpropyl)pyrazole-3-carboxamide CAS Name: 2-(3-carbamimidoylphenyl)-5-methyl-N-(3-phenylpropyl)-3-pyrazolecarboxamide IUPAC Name: 2-(3-carbamimidoylphenyl)-5-methyl-N-(3-phenylpropyl)pyrazole-3-carboxamide Traditional Name: 2-(3-amidinophenyl)-5-methyl-N-(3-phenylpropyl)pyrazole-3-carboxamide Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NCCCC2=CC=CC=C2)C3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NCCCC2=CC=CC=C2)C3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C21H23N5O/c1-15-13-19(21(27)24-12-6-9-16-7-3-2-4-8-16)26(25-15)18-11-5-10-17(14-18)20(22)23/h2-5,7-8,10-11,13-14H,6,9,12H2,1H3,(H3,22,23)(H,24,27)