N-[2-[3-(aminomethyl)phenoxy]-4-chloranyl-phenyl]-5-bromanyl-N-[4-[(2-fluorophenyl)methylamino]-4-oxidanylidene-butyl]furan-2-carboxamide hydrochloride

Systemtic Name: N-[2-[3-(aminomethyl)phenoxy]-4-chloranyl-phenyl]-5-bromanyl-N-[4-[(2-fluorophenyl)methylamino]-4-oxidanylidene-butyl]furan-2-carboxamide hydrochloride Openeye Name: N-[2-[3-(aminomethyl)phenoxy]-4-chloro-phenyl]-5-bromo-N-[4-[(2-fluorophenyl)methylamino]-4-oxo-butyl]furan-2-carboxamide hydrochloride CAS Name: N-[2-[3-(aminomethyl)phenoxy]-4-chlorophenyl]-5-bromo-N-[4-[(2-fluorophenyl)methylamino]-4-oxobutyl]-2-furancarboxamide hydrochloride IUPAC Name: N-[2-[3-(aminomethyl)phenoxy]-4-chlorophenyl]-5-bromo-N-[4-[(2-fluorophenyl)methylamino]-4-oxobutyl]furan-2-carboxamide hydrochloride Traditional Name: N-[2-[3-(aminomethyl)phenoxy]-4-chloro-phenyl]-5-bromo-N-[4-[(2-fluorobenzyl)amino]-4-keto-butyl]-2-furamide hydrochloride Formula: C29H27BrCl2FN3O4 MolecularWeight: 651.350783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)CCCN(C2=C(C=C(C=C2)Cl)OC3=CC=CC(=C3)CN)C(=O)C4=CC=C(O4)Br)F.Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)CCCN(C2=C(C=C(C=C2)Cl)OC3=CC=CC(=C3)CN)C(=O)C4=CC=C(O4)Br)F.Cl

InChI

InChI=1S/C29H26BrClFN3O4.ClH/c30-27-13-12-25(39-27)29(37)35(14-4-9-28(36)34-18-20-6-1-2-8-23(20)32)24-11-10-21(31)16-26(24)38-22-7-3-5-19(15-22)17-33;/h1-3,5-8,10-13,15-16H,4,9,14,17-18,33H2,(H,34,36);1H