N-[4-(2H-benzotriazol-5-ylamino)pyrido[4,3-d]pyrimidin-7-yl]prop-2-ynamide

Systemtic Name: N-[4-(2H-benzotriazol-5-ylamino)pyrido[4,3-d]pyrimidin-7-yl]prop-2-ynamide Openeye Name: N-[4-(2H-benzotriazol-5-ylamino)pyrido[4,3-d]pyrimidin-7-yl]prop-2-ynamide CAS Name: N-[4-(2H-benzotriazol-5-ylamino)-7-pyrido[4,3-d]pyrimidinyl]-2-propynamide IUPAC Name: N-[4-(2H-benzotriazol-5-ylamino)pyrido[4,3-d]pyrimidin-7-yl]prop-2-ynamide Traditional Name: N-[4-(2H-benzotriazol-5-ylamino)pyrido[4,3-d]pyrimidin-7-yl]propiolamide Formula: C16H10N8O MolecularWeight: 330.3036

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(=O)NC1=NC=C2C(=C1)N=CN=C2NC3=CC4=NNN=C4C=C3

Isomeric SMILES

C#CC(=O)NC1=NC=C2C(=C1)N=CN=C2NC3=CC4=NNN=C4C=C3

InChI

InChI=1S/C16H10N8O/c1-2-15(25)21-14-6-12-10(7-17-14)16(19-8-18-12)20-9-3-4-11-13(5-9)23-24-22-11/h1,3-8H,(H,17,21,25)(H,18,19,20)(H,22,23,24)