7-[[2-[(3-carbamimidoylphenyl)methyl]-3-oxidanylidene-5-propan-2-yl-1H-pyrazol-4-yl]methyl]naphthalene-2-carboximidamide

Systemtic Name: 7-[[2-[(3-carbamimidoylphenyl)methyl]-3-oxidanylidene-5-propan-2-yl-1H-pyrazol-4-yl]methyl]naphthalene-2-carboximidamide Openeye Name: 7-[[2-[(3-carbamimidoylphenyl)methyl]-5-isopropyl-3-oxo-1H-pyrazol-4-yl]methyl]naphthalene-2-carboxamidine CAS Name: 7-[[2-[(3-carbamimidoylphenyl)methyl]-3-oxo-5-propan-2-yl-1H-pyrazol-4-yl]methyl]-2-naphthalenecarboximidamide IUPAC Name: 7-[[2-[(3-carbamimidoylphenyl)methyl]-3-oxo-5-propan-2-yl-1H-pyrazol-4-yl]methyl]naphthalene-2-carboximidamide Traditional Name: 7-[[1-(3-amidinobenzyl)-3-isopropyl-5-keto-3-pyrazolin-4-yl]methyl]-2-naphthamidine Formula: C26H28N6O MolecularWeight: 440.54012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=O)N(N1)CC2=CC=CC(=C2)C(=N)N)CC3=CC4=C(C=C3)C=CC(=C4)C(=N)N

Isomeric SMILES

CC(C)C1=C(C(=O)N(N1)CC2=CC=CC(=C2)C(=N)N)CC3=CC4=C(C=C3)C=CC(=C4)C(=N)N

InChI

InChI=1S/C26H28N6O/c1-15(2)23-22(12-16-6-7-18-8-9-20(25(29)30)13-21(18)10-16)26(33)32(31-23)14-17-4-3-5-19(11-17)24(27)28/h3-11,13,15,31H,12,14H2,1-2H3,(H3,27,28)(H3,29,30)