3-methyl-2-(phenylcarbamoylamino)-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]butanamide

Systemtic Name: 3-methyl-2-(phenylcarbamoylamino)-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]butanamide Openeye Name: 3-methyl-2-(phenylcarbamoylamino)-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]butanamide CAS Name: 2-[[anilino(oxo)methyl]amino]-3-methyl-N-[[2-(1-pyrazolyl)-4-pyridinyl]methyl]butanamide IUPAC Name: 3-methyl-2-(phenylcarbamoylamino)-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]butanamide Traditional Name: 3-methyl-2-(phenylcarbamoylamino)-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]butyramide Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC(=NC=C1)N2C=CC=N2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)NCC1=CC(=NC=C1)N2C=CC=N2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H24N6O2/c1-15(2)19(26-21(29)25-17-7-4-3-5-8-17)20(28)23-14-16-9-11-22-18(13-16)27-12-6-10-24-27/h3-13,15,19H,14H2,1-2H3,(H,23,28)(H2,25,26,29)