1-azanyl-2-ethanoyl-4-[[4-phenyl-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]amino]anthracene-9,10-dione

Systemtic Name: 1-azanyl-2-ethanoyl-4-[[4-phenyl-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]amino]anthracene-9,10-dione Openeye Name: 2-acetyl-1-amino-4-[[4-(isopropylamino)-6-phenyl-1,3,5-triazin-2-yl]amino]anthracene-9,10-dione CAS Name: 2-acetyl-1-amino-4-[[4-phenyl-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]amino]anthracene-9,10-dione IUPAC Name: 2-acetyl-1-amino-4-[[4-phenyl-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]amino]anthracene-9,10-dione Traditional Name: 2-acetyl-1-amino-4-[[4-(isopropylamino)-6-phenyl-s-triazin-2-yl]amino]-9,10-anthraquinone Formula: C28H24N6O3 MolecularWeight: 492.52856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC(=NC(=N1)NC2=C3C(=C(C(=C2)C(=O)C)N)C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5

Isomeric SMILES

CC(C)NC1=NC(=NC(=N1)NC2=C3C(=C(C(=C2)C(=O)C)N)C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5

InChI

InChI=1S/C28H24N6O3/c1-14(2)30-27-32-26(16-9-5-4-6-10-16)33-28(34-27)31-20-13-19(15(3)35)23(29)22-21(20)24(36)17-11-7-8-12-18(17)25(22)37/h4-14H,29H2,1-3H3,(H2,30,31,32,33,34)