(3S)-3-(aminocarbonylamino)-3-phenyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: (3S)-3-(aminocarbonylamino)-3-phenyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: (3S)-3-phenyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-3-ureido-propanamide CAS Name: (3S)-3-(carbamoylamino)-3-phenyl-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]propanamide IUPAC Name: (3S)-3-(carbamoylamino)-3-phenyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: (3S)-3-phenyl-N-[2-(pyrazol-1-ylmethyl)benzyl]-3-ureido-propionamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)NCC2=CC=CC=C2CN3C=CC=N3)NC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)[C@H](CC(=O)NCC2=CC=CC=C2CN3C=CC=N3)NC(=O)N

InChI

InChI=1S/C21H23N5O2/c22-21(28)25-19(16-7-2-1-3-8-16)13-20(27)23-14-17-9-4-5-10-18(17)15-26-12-6-11-24-26/h1-12,19H,13-15H2,(H,23,27)(H3,22,25,28)/t19-/m0/s1