1-(1,2-benzoxazol-3-ylmethyl)-3-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]urea

Systemtic Name: 1-(1,2-benzoxazol-3-ylmethyl)-3-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]urea Openeye Name: 1-(1,2-benzoxazol-3-ylmethyl)-3-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]urea CAS Name: 1-(1,2-benzoxazol-3-ylmethyl)-3-[4-[(4-ethyl-1-piperazinyl)methyl]phenyl]urea IUPAC Name: 1-(1,2-benzoxazol-3-ylmethyl)-3-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]urea Traditional Name: 1-[4-[(4-ethylpiperazino)methyl]phenyl]-3-(indoxazen-3-ylmethyl)urea Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=CC=C(C=C2)NC(=O)NCC3=NOC4=CC=CC=C43

Isomeric SMILES

CCN1CCN(CC1)CC2=CC=C(C=C2)NC(=O)NCC3=NOC4=CC=CC=C43

InChI

InChI=1S/C22H27N5O2/c1-2-26-11-13-27(14-12-26)16-17-7-9-18(10-8-17)24-22(28)23-15-20-19-5-3-4-6-21(19)29-25-20/h3-10H,2,11-16H2,1H3,(H2,23,24,28)