N-[4-(2H-benzotriazol-5-ylamino)pyrido[3,4-d]pyrimidin-6-yl]buta-2,3-dienamide

Systemtic Name: N-[4-(2H-benzotriazol-5-ylamino)pyrido[3,4-d]pyrimidin-6-yl]buta-2,3-dienamide Openeye Name: N-[4-(2H-benzotriazol-5-ylamino)pyrido[3,4-d]pyrimidin-6-yl]buta-2,3-dienamide CAS Name: N-[4-(2H-benzotriazol-5-ylamino)-6-pyrido[3,4-d]pyrimidinyl]buta-2,3-dienamide IUPAC Name: N-[4-(2H-benzotriazol-5-ylamino)pyrido[3,4-d]pyrimidin-6-yl]buta-2,3-dienamide Traditional Name: N-[4-(2H-benzotriazol-5-ylamino)pyrido[3,4-d]pyrimidin-6-yl]buta-2,3-dienamide Formula: C17H12N8O MolecularWeight: 344.33018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C=CC(=O)NC1=NC=C2C(=C1)C(=NC=N2)NC3=CC4=NNN=C4C=C3

Isomeric SMILES

C=C=CC(=O)NC1=NC=C2C(=C1)C(=NC=N2)NC3=CC4=NNN=C4C=C3

InChI

InChI=1S/C17H12N8O/c1-2-3-16(26)22-15-7-11-14(8-18-15)19-9-20-17(11)21-10-4-5-12-13(6-10)24-25-23-12/h3-9H,1H2,(H,18,22,26)(H,19,20,21)(H,23,24,25)