2-[(4-carbamimidoylphenyl)carbamoylamino]-N-[1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]ethanamide

Systemtic Name: 2-[(4-carbamimidoylphenyl)carbamoylamino]-N-[1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]ethanamide Openeye Name: 2-[(4-carbamimidoylphenyl)carbamoylamino]-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]acetamide CAS Name: 2-[[(4-carbamimidoylanilino)-oxomethyl]amino]-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]acetamide IUPAC Name: 2-[(4-carbamimidoylphenyl)carbamoylamino]-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]acetamide Traditional Name: 2-[(4-amidinophenyl)carbamoylamino]-N-[1-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl]acetamide Formula: C20H22N6O4 MolecularWeight: 410.42648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCC(=O)N2)NC(=O)CNC(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCC(=O)N2)NC(=O)CNC(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H22N6O4/c1-11(13-4-7-16-15(8-13)26-18(28)10-30-16)24-17(27)9-23-20(29)25-14-5-2-12(3-6-14)19(21)22/h2-8,11H,9-10H2,1H3,(H3,21,22)(H,24,27)(H,26,28)(H2,23,25,29)