1-[3-[(3-oxidanylidene-8-piperazin-1-yl-1,4-benzoxazin-4-yl)methyl]phenyl]urea

Systemtic Name: 1-[3-[(3-oxidanylidene-8-piperazin-1-yl-1,4-benzoxazin-4-yl)methyl]phenyl]urea Openeye Name: [3-[(3-oxo-8-piperazin-1-yl-1,4-benzoxazin-4-yl)methyl]phenyl]urea CAS Name: [3-[[3-oxo-8-(1-piperazinyl)-1,4-benzoxazin-4-yl]methyl]phenyl]urea IUPAC Name: [3-[(3-oxo-8-piperazin-1-yl-1,4-benzoxazin-4-yl)methyl]phenyl]urea Traditional Name: [3-[(3-keto-8-piperazino-1,4-benzoxazin-4-yl)methyl]phenyl]urea Formula: C20H23N5O3 MolecularWeight: 381.42832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC3=C2OCC(=O)N3CC4=CC(=CC=C4)NC(=O)N

Isomeric SMILES

C1CN(CCN1)C2=CC=CC3=C2OCC(=O)N3CC4=CC(=CC=C4)NC(=O)N

InChI

InChI=1S/C20H23N5O3/c21-20(27)23-15-4-1-3-14(11-15)12-25-17-6-2-5-16(19(17)28-13-18(25)26)24-9-7-22-8-10-24/h1-6,11,22H,7-10,12-13H2,(H3,21,23,27)