3-(1-methylbenzotriazol-5-yl)-1-(phenylmethyl)-1-propyl-urea

Systemtic Name: 3-(1-methylbenzotriazol-5-yl)-1-(phenylmethyl)-1-propyl-urea Openeye Name: 1-benzyl-3-(1-methylbenzotriazol-5-yl)-1-propyl-urea CAS Name: 3-(1-methyl-5-benzotriazolyl)-1-(phenylmethyl)-1-propylurea IUPAC Name: 1-benzyl-3-(1-methylbenzotriazol-5-yl)-1-propylurea Traditional Name: 1-benzyl-3-(1-methylbenzotriazol-5-yl)-1-propyl-urea Formula: C18H21N5O MolecularWeight: 323.39224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)N(N=N3)C

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)N(N=N3)C

InChI

InChI=1S/C18H21N5O/c1-3-11-23(13-14-7-5-4-6-8-14)18(24)19-15-9-10-17-16(12-15)20-21-22(17)2/h4-10,12H,3,11,13H2,1-2H3,(H,19,24)