2-[4-[[4-(1,2,4-oxadiazol-5-ylamino)-5,6,7,8-tetrahydroquinazolin-2-yl]amino]phenyl]ethanenitrile

Systemtic Name: 2-[4-[[4-(1,2,4-oxadiazol-5-ylamino)-5,6,7,8-tetrahydroquinazolin-2-yl]amino]phenyl]ethanenitrile Openeye Name: 2-[4-[[4-(1,2,4-oxadiazol-5-ylamino)-5,6,7,8-tetrahydroquinazolin-2-yl]amino]phenyl]acetonitrile CAS Name: 2-[4-[[4-(1,2,4-oxadiazol-5-ylamino)-5,6,7,8-tetrahydroquinazolin-2-yl]amino]phenyl]acetonitrile IUPAC Name: 2-[4-[[4-(1,2,4-oxadiazol-5-ylamino)-5,6,7,8-tetrahydroquinazolin-2-yl]amino]phenyl]acetonitrile Traditional Name: 2-[4-[[4-(1,2,4-oxadiazol-5-ylamino)-5,6,7,8-tetrahydroquinazolin-2-yl]amino]phenyl]acetonitrile Formula: C18H17N7O MolecularWeight: 347.37388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NC(=N2)NC3=CC=C(C=C3)CC#N)NC4=NC=NO4

Isomeric SMILES

C1CCC2=C(C1)C(=NC(=N2)NC3=CC=C(C=C3)CC#N)NC4=NC=NO4

InChI

InChI=1S/C18H17N7O/c19-10-9-12-5-7-13(8-6-12)22-17-23-15-4-2-1-3-14(15)16(24-17)25-18-20-11-21-26-18/h5-8,11H,1-4,9H2,(H2,20,21,22,23,24,25)