6-azanyl-4-(4-bromophenyl)-3-methyl-1-(phenylmethyl)-4H-pyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-4-(4-bromophenyl)-3-methyl-1-(phenylmethyl)-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-1-benzyl-4-(4-bromophenyl)-3-methyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-(4-bromophenyl)-3-methyl-1-(phenylmethyl)-4H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-1-benzyl-4-(4-bromophenyl)-3-methyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-1-benzyl-4-(4-bromophenyl)-3-methyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C21H17BrN4O MolecularWeight: 421.28988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC=C(C=C3)Br)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC=C(C=C3)Br)CC4=CC=CC=C4

InChI

InChI=1S/C21H17BrN4O/c1-13-18-19(15-7-9-16(22)10-8-15)17(11-23)20(24)27-21(18)26(25-13)12-14-5-3-2-4-6-14/h2-10,19H,12,24H2,1H3