N1-(2-aminophenyl)-N4-[2-(pentan-3-ylamino)-1-phenyl-ethyl]benzene-1,4-dicarboxamide

Systemtic Name: N1-(2-aminophenyl)-N4-[2-(pentan-3-ylamino)-1-phenyl-ethyl]benzene-1,4-dicarboxamide Openeye Name: N1-(2-aminophenyl)-N4-[2-(1-ethylpropylamino)-1-phenyl-ethyl]terephthalamide CAS Name: N1-(2-aminophenyl)-N4-[2-(pentan-3-ylamino)-1-phenylethyl]benzene-1,4-dicarboxamide IUPAC Name: 1-N-(2-aminophenyl)-4-N-[2-(pentan-3-ylamino)-1-phenylethyl]benzene-1,4-dicarboxamide Traditional Name: N-(2-aminophenyl)-N'-[2-(1-ethylpropylamino)-1-phenyl-ethyl]terephthalamide Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NCC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N

Isomeric SMILES

CCC(CC)NCC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N

InChI

InChI=1S/C27H32N4O2/c1-3-22(4-2)29-18-25(19-10-6-5-7-11-19)31-27(33)21-16-14-20(15-17-21)26(32)30-24-13-9-8-12-23(24)28/h5-17,22,25,29H,3-4,18,28H2,1-2H3,(H,30,32)(H,31,33)