2-azanyl-N-[1-[(2-diazanyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-propan-2-yl]-3-(4-phenylmethoxyphenyl)propanamide

Systemtic Name: 2-azanyl-N-[1-[(2-diazanyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-propan-2-yl]-3-(4-phenylmethoxyphenyl)propanamide Openeye Name: 2-amino-3-(4-benzyloxyphenyl)-N-[2-[(2-hydrazino-2-oxo-ethyl)amino]-1-methyl-2-oxo-ethyl]propanamide CAS Name: 2-amino-N-[1-[(2-hydrazinyl-2-oxoethyl)amino]-1-oxopropan-2-yl]-3-(4-phenylmethoxyphenyl)propanamide IUPAC Name: 2-amino-N-[1-[(2-hydrazinyl-2-oxoethyl)amino]-1-oxopropan-2-yl]-3-(4-phenylmethoxyphenyl)propanamide Traditional Name: 2-amino-3-(4-benzoxyphenyl)-N-[2-[(2-hydrazino-2-keto-ethyl)amino]-2-keto-1-methyl-ethyl]propionamide Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(=O)NN)NC(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)N

Isomeric SMILES

CC(C(=O)NCC(=O)NN)NC(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)N

InChI

InChI=1S/C21H27N5O4/c1-14(20(28)24-12-19(27)26-23)25-21(29)18(22)11-15-7-9-17(10-8-15)30-13-16-5-3-2-4-6-16/h2-10,14,18H,11-13,22-23H2,1H3,(H,24,28)(H,25,29)(H,26,27)