N-[[4-(aminocarbonylamino)phenyl]methyl]-1-(1,3-benzoxazol-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[[4-(aminocarbonylamino)phenyl]methyl]-1-(1,3-benzoxazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(1,3-benzoxazol-2-yl)-N-[(4-ureidophenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(1,3-benzoxazol-2-yl)-N-[[4-(carbamoylamino)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(1,3-benzoxazol-2-yl)-N-[[4-(carbamoylamino)phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-(1,3-benzoxazol-2-yl)-N-(4-ureidobenzyl)isonipecotamide Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)NC(=O)N)C3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)NC(=O)N)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H23N5O3/c22-20(28)24-16-7-5-14(6-8-16)13-23-19(27)15-9-11-26(12-10-15)21-25-17-3-1-2-4-18(17)29-21/h1-8,15H,9-13H2,(H,23,27)(H3,22,24,28)