2-azanyl-3-(1H-imidazol-5-yl)-1-(7,8,21,23-tetrahydroporphyrin-2-yl)propan-1-one

Systemtic Name: 2-azanyl-3-(1H-imidazol-5-yl)-1-(7,8,21,23-tetrahydroporphyrin-2-yl)propan-1-one Openeye Name: 2-amino-3-(1H-imidazol-5-yl)-1-(7,8,21,23-tetrahydroporphyrin-2-yl)propan-1-one CAS Name: 2-amino-3-(1H-imidazol-5-yl)-1-(7,8,21,23-tetrahydroporphyrin-2-yl)-1-propanone IUPAC Name: 2-amino-3-(1H-imidazol-5-yl)-1-(7,8,21,23-tetrahydroporphyrin-2-yl)propan-1-one Traditional Name: 2-amino-3-(1H-imidazol-5-yl)-1-(7,8,21,23-tetrahydroporphin-2-yl)propan-1-one Formula: C26H23N7O MolecularWeight: 449.50712

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC1=CC3=CC(=C(N3)C=C4C=CC(=N4)C=C5C=CC(=C2)N5)C(=O)C(CC6=CN=CN6)N

Isomeric SMILES

C1CC2=NC1=CC3=CC(=C(N3)C=C4C=CC(=N4)C=C5C=CC(=C2)N5)C(=O)C(CC6=CN=CN6)N

InChI

InChI=1S/C26H23N7O/c27-24(11-22-13-28-14-29-22)26(34)23-10-21-9-19-4-3-17(31-19)7-15-1-2-16(30-15)8-18-5-6-20(32-18)12-25(23)33-21/h1-2,5-10,12-14,24,30,33H,3-4,11,27H2,(H,28,29)