ethyl 3-[[2-azanyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]ethyl]carbamoylamino]propanoate

Systemtic Name: ethyl 3-[[2-azanyl-2-[4-(pyridin-4-ylcarbamoyl)phenyl]ethyl]carbamoylamino]propanoate Openeye Name: ethyl 3-[[2-amino-2-[4-(4-pyridylcarbamoyl)phenyl]ethyl]carbamoylamino]propanoate CAS Name: 3-[[[[2-amino-2-[4-[oxo-(pyridin-4-ylamino)methyl]phenyl]ethyl]amino]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-amino-2-[4-(pyridin-4-ylcarbamoyl)phenyl]ethyl]carbamoylamino]propanoate Traditional Name: 3-[[2-amino-2-[4-(4-pyridylcarbamoyl)phenyl]ethyl]carbamoylamino]propionic acid ethyl ester Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)NCC(C1=CC=C(C=C1)C(=O)NC2=CC=NC=C2)N

Isomeric SMILES

CCOC(=O)CCNC(=O)NCC(C1=CC=C(C=C1)C(=O)NC2=CC=NC=C2)N

InChI

InChI=1S/C20H25N5O4/c1-2-29-18(26)9-12-23-20(28)24-13-17(21)14-3-5-15(6-4-14)19(27)25-16-7-10-22-11-8-16/h3-8,10-11,17H,2,9,12-13,21H2,1H3,(H,22,25,27)(H2,23,24,28)