1-[4-[4-(2,6-ditert-butylpyrimidin-4-yl)piperazin-1-yl]butanoyl]-3,4-dihydro-1-benzazepine-2,5-dione

Systemtic Name: 1-[4-[4-(2,6-ditert-butylpyrimidin-4-yl)piperazin-1-yl]butanoyl]-3,4-dihydro-1-benzazepine-2,5-dione Openeye Name: 1-[4-[4-(2,6-ditert-butylpyrimidin-4-yl)piperazin-1-yl]butanoyl]-3,4-dihydro-1-benzazepine-2,5-dione CAS Name: 1-[4-[4-(2,6-ditert-butyl-4-pyrimidinyl)-1-piperazinyl]-1-oxobutyl]-3,4-dihydro-1-benzazepine-2,5-dione IUPAC Name: 1-[4-[4-(2,6-ditert-butylpyrimidin-4-yl)piperazin-1-yl]butanoyl]-3,4-dihydro-1-benzazepine-2,5-dione Traditional Name: 1-[4-[4-(2,6-ditert-butylpyrimidin-4-yl)piperazino]butanoyl]-3,4-dihydro-1-benzazepine-2,5-quinone Formula: C30H41N5O3 MolecularWeight: 519.67824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)C(C)(C)C)N2CCN(CC2)CCCC(=O)N3C(=O)CCC(=O)C4=CC=CC=C43

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)C(C)(C)C)N2CCN(CC2)CCCC(=O)N3C(=O)CCC(=O)C4=CC=CC=C43

InChI

InChI=1S/C30H41N5O3/c1-29(2,3)24-20-25(32-28(31-24)30(4,5)6)34-18-16-33(17-19-34)15-9-12-26(37)35-22-11-8-7-10-21(22)23(36)13-14-27(35)38/h7-8,10-11,20H,9,12-19H2,1-6H3