6-azanyl-4-[3-(benzotriazol-1-ylmethyl)-4-methoxy-phenyl]-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-4-[3-(benzotriazol-1-ylmethyl)-4-methoxy-phenyl]-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-[3-(benzotriazol-1-ylmethyl)-4-methoxy-phenyl]-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-[3-(1-benzotriazolylmethyl)-4-methoxyphenyl]-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-4-[3-(benzotriazol-1-ylmethyl)-4-methoxyphenyl]-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-[3-(benzotriazol-1-ylmethyl)-4-methoxy-phenyl]-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C27H21N7O2 MolecularWeight: 475.50134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=C(OC3=NNC(=C23)C4=CC=CC=C4)N)C#N)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(=C(OC3=NNC(=C23)C4=CC=CC=C4)N)C#N)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C27H21N7O2/c1-35-22-12-11-17(13-18(22)15-34-21-10-6-5-9-20(21)30-33-34)23-19(14-28)26(29)36-27-24(23)25(31-32-27)16-7-3-2-4-8-16/h2-13,23H,15,29H2,1H3,(H,31,32)