3-(aminocarbonylamino)-3-(2-methylphenyl)-N-[(4-pyrazol-1-ylphenyl)methyl]propanamide

Systemtic Name: 3-(aminocarbonylamino)-3-(2-methylphenyl)-N-[(4-pyrazol-1-ylphenyl)methyl]propanamide Openeye Name: 3-(o-tolyl)-N-[(4-pyrazol-1-ylphenyl)methyl]-3-ureido-propanamide CAS Name: 3-(carbamoylamino)-3-(2-methylphenyl)-N-[[4-(1-pyrazolyl)phenyl]methyl]propanamide IUPAC Name: 3-(carbamoylamino)-3-(2-methylphenyl)-N-[(4-pyrazol-1-ylphenyl)methyl]propanamide Traditional Name: 3-(o-tolyl)-N-(4-pyrazol-1-ylbenzyl)-3-ureido-propionamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CC(=O)NCC2=CC=C(C=C2)N3C=CC=N3)NC(=O)N

Isomeric SMILES

CC1=CC=CC=C1C(CC(=O)NCC2=CC=C(C=C2)N3C=CC=N3)NC(=O)N

InChI

InChI=1S/C21H23N5O2/c1-15-5-2-3-6-18(15)19(25-21(22)28)13-20(27)23-14-16-7-9-17(10-8-16)26-12-4-11-24-26/h2-12,19H,13-14H2,1H3,(H,23,27)(H3,22,25,28)