N-[3-(azepin-1-yl)propyl]-3-(furan-3-yl)-N-(naphthalen-1-ylmethyl)-1,2-oxazol-5-amine

Systemtic Name: N-[3-(azepin-1-yl)propyl]-3-(furan-3-yl)-N-(naphthalen-1-ylmethyl)-1,2-oxazol-5-amine Openeye Name: N-[3-(azepin-1-yl)propyl]-3-(3-furyl)-N-(1-naphthylmethyl)isoxazol-5-amine CAS Name: N-[3-(1-azepinyl)propyl]-3-(3-furanyl)-N-(1-naphthalenylmethyl)-5-isoxazolamine IUPAC Name: N-[3-(azepin-1-yl)propyl]-3-(furan-3-yl)-N-(naphthalen-1-ylmethyl)-1,2-oxazol-5-amine Traditional Name: 3-(azepin-1-yl)propyl-[3-(3-furyl)isoxazol-5-yl]-(1-naphthylmethyl)amine Formula: C27H25N3O2 MolecularWeight: 423.5063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=CN(C=C1)CCCN(CC2=CC=CC3=CC=CC=C32)C4=CC(=NO4)C5=COC=C5

Isomeric SMILES

C1=CC=CN(C=C1)CCCN(CC2=CC=CC3=CC=CC=C32)C4=CC(=NO4)C5=COC=C5

InChI

InChI=1S/C27H25N3O2/c1-2-6-15-29(14-5-1)16-8-17-30(27-19-26(28-32-27)24-13-18-31-21-24)20-23-11-7-10-22-9-3-4-12-25(22)23/h1-7,9-15,18-19,21H,8,16-17,20H2