1-[(4-cyanophenyl)carbamoylamino]-3-[4-(2-oxidanylidenepiperazin-1-yl)phenyl]-1-phenyl-urea

Systemtic Name: 1-[(4-cyanophenyl)carbamoylamino]-3-[4-(2-oxidanylidenepiperazin-1-yl)phenyl]-1-phenyl-urea Openeye Name: 1-[(4-cyanophenyl)carbamoylamino]-3-[4-(2-oxopiperazin-1-yl)phenyl]-1-phenyl-urea CAS Name: 1-[[(4-cyanoanilino)-oxomethyl]amino]-3-[4-(2-oxo-1-piperazinyl)phenyl]-1-phenylurea IUPAC Name: 1-[(4-cyanophenyl)carbamoylamino]-3-[4-(2-oxopiperazin-1-yl)phenyl]-1-phenylurea Traditional Name: 1-[(4-cyanophenyl)carbamoylamino]-3-[4-(2-ketopiperazino)phenyl]-1-phenyl-urea Formula: C25H23N7O3 MolecularWeight: 469.49522

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1)C2=CC=C(C=C2)NC(=O)N(C3=CC=CC=C3)NC(=O)NC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(C(=O)CN1)C2=CC=C(C=C2)NC(=O)N(C3=CC=CC=C3)NC(=O)NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H23N7O3/c26-16-18-6-8-19(9-7-18)28-24(34)30-32(22-4-2-1-3-5-22)25(35)29-20-10-12-21(13-11-20)31-15-14-27-17-23(31)33/h1-13,27H,14-15,17H2,(H,29,35)(H2,28,30,34)