3-azanyl-7-(3-oxidanylpropoxy)-N-[3-[(phenylcarbamoylamino)methyl]phenyl]-1,2-benzoxazole-4-carboxamide

Systemtic Name: 3-azanyl-7-(3-oxidanylpropoxy)-N-[3-[(phenylcarbamoylamino)methyl]phenyl]-1,2-benzoxazole-4-carboxamide Openeye Name: 3-amino-7-(3-hydroxypropoxy)-N-[3-[(phenylcarbamoylamino)methyl]phenyl]-1,2-benzoxazole-4-carboxamide CAS Name: 3-amino-N-[3-[[[anilino(oxo)methyl]amino]methyl]phenyl]-7-(3-hydroxypropoxy)-1,2-benzoxazole-4-carboxamide IUPAC Name: 3-amino-7-(3-hydroxypropoxy)-N-[3-[(phenylcarbamoylamino)methyl]phenyl]-1,2-benzoxazole-4-carboxamide Traditional Name: 3-amino-7-(3-hydroxypropoxy)-N-[3-[(phenylcarbamoylamino)methyl]phenyl]indoxazene-4-carboxamide Formula: C25H25N5O5 MolecularWeight: 475.4965

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NCC2=CC(=CC=C2)NC(=O)C3=C4C(=C(C=C3)OCCCO)ON=C4N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NCC2=CC(=CC=C2)NC(=O)C3=C4C(=C(C=C3)OCCCO)ON=C4N

InChI

InChI=1S/C25H25N5O5/c26-23-21-19(10-11-20(22(21)35-30-23)34-13-5-12-31)24(32)28-18-9-4-6-16(14-18)15-27-25(33)29-17-7-2-1-3-8-17/h1-4,6-11,14,31H,5,12-13,15H2,(H2,26,30)(H,28,32)(H2,27,29,33)