3-azanyl-3-[2-[3-azanyl-5-(4-methylphenyl)-4-oxidanylidene-pent-1-yn-3-yl]phenyl]-1-(4-methylphenyl)pent-4-yn-2-one

Systemtic Name: 3-azanyl-3-[2-[3-azanyl-5-(4-methylphenyl)-4-oxidanylidene-pent-1-yn-3-yl]phenyl]-1-(4-methylphenyl)pent-4-yn-2-one Openeye Name: 3-amino-3-[2-[1-amino-1-[2-(p-tolyl)acetyl]prop-2-ynyl]phenyl]-1-(p-tolyl)pent-4-yn-2-one CAS Name: 3-amino-3-[2-[3-amino-5-(4-methylphenyl)-4-oxopent-1-yn-3-yl]phenyl]-1-(4-methylphenyl)-4-pentyn-2-one IUPAC Name: 3-amino-3-[2-[3-amino-5-(4-methylphenyl)-4-oxopent-1-yn-3-yl]phenyl]-1-(4-methylphenyl)pent-4-yn-2-one Traditional Name: 3-amino-3-[2-[1-amino-1-[2-(p-tolyl)acetyl]prop-2-ynyl]phenyl]-1-(p-tolyl)pent-4-yn-2-one Formula: C30H28N2O2 MolecularWeight: 448.55552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(=O)C(C#C)(C2=CC=CC=C2C(C#C)(C(=O)CC3=CC=C(C=C3)C)N)N

Isomeric SMILES

CC1=CC=C(C=C1)CC(=O)C(C#C)(C2=CC=CC=C2C(C#C)(C(=O)CC3=CC=C(C=C3)C)N)N

InChI

InChI=1S/C30H28N2O2/c1-5-29(31,27(33)19-23-15-11-21(3)12-16-23)25-9-7-8-10-26(25)30(32,6-2)28(34)20-24-17-13-22(4)14-18-24/h1-2,7-18H,19-20,31-32H2,3-4H3