7-[2-(ethoxycarbonylamino)-7-pyrimidin-2-yl-3H-benzimidazol-5-yl]-1-oxidanylidene-4-(propan-2-ylamino)-4H-naphthalene-2-carboxylic acid

Systemtic Name: 7-[2-(ethoxycarbonylamino)-7-pyrimidin-2-yl-3H-benzimidazol-5-yl]-1-oxidanylidene-4-(propan-2-ylamino)-4H-naphthalene-2-carboxylic acid Openeye Name: 7-[2-(ethoxycarbonylamino)-7-pyrimidin-2-yl-3H-benzimidazol-5-yl]-4-(isopropylamino)-1-oxo-4H-naphthalene-2-carboxylic acid CAS Name: 7-[2-(ethoxycarbonylamino)-7-(2-pyrimidinyl)-3H-benzimidazol-5-yl]-1-oxo-4-(propan-2-ylamino)-4H-naphthalene-2-carboxylic acid IUPAC Name: 7-[2-(ethoxycarbonylamino)-7-pyrimidin-2-yl-3H-benzimidazol-5-yl]-1-oxo-4-(propan-2-ylamino)-4H-naphthalene-2-carboxylic acid Traditional Name: 7-[2-(carbethoxyamino)-7-(2-pyrimidyl)-3H-benzimidazol-5-yl]-4-(isopropylamino)-1-keto-4H-naphthalene-2-carboxylic acid Formula: C28H26N6O5 MolecularWeight: 526.54324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CC4=C(C=C3)C(C=C(C4=O)C(=O)O)NC(C)C)C5=NC=CC=N5

Isomeric SMILES

CCOC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CC4=C(C=C3)C(C=C(C4=O)C(=O)O)NC(C)C)C5=NC=CC=N5

InChI

InChI=1S/C28H26N6O5/c1-4-39-28(38)34-27-32-22-12-16(11-19(23(22)33-27)25-29-8-5-9-30-25)15-6-7-17-18(10-15)24(35)20(26(36)37)13-21(17)31-14(2)3/h5-14,21,31H,4H2,1-3H3,(H,36,37)(H2,32,33,34,38)