(3S)-3-(aminocarbonylamino)-3-(3-phenoxyphenyl)-N-(pyridin-4-ylmethyl)propanamide

Systemtic Name: (3S)-3-(aminocarbonylamino)-3-(3-phenoxyphenyl)-N-(pyridin-4-ylmethyl)propanamide Openeye Name: (3S)-3-(3-phenoxyphenyl)-N-(4-pyridylmethyl)-3-ureido-propanamide CAS Name: (3S)-3-(carbamoylamino)-3-(3-phenoxyphenyl)-N-(pyridin-4-ylmethyl)propanamide IUPAC Name: (3S)-3-(carbamoylamino)-3-(3-phenoxyphenyl)-N-(pyridin-4-ylmethyl)propanamide Traditional Name: (3S)-3-(3-phenoxyphenyl)-N-(4-pyridylmethyl)-3-ureido-propionamide Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C(CC(=O)NCC3=CC=NC=C3)NC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)[C@H](CC(=O)NCC3=CC=NC=C3)NC(=O)N

InChI

InChI=1S/C22H22N4O3/c23-22(28)26-20(14-21(27)25-15-16-9-11-24-12-10-16)17-5-4-8-19(13-17)29-18-6-2-1-3-7-18/h1-13,20H,14-15H2,(H,25,27)(H3,23,26,28)/t20-/m0/s1