[aminocarbonyl-[1-(1-benzothiophen-2-yl)ethyl]amino] 2-(3-phenyl-1-benzofuran-7-yl)propanoate

Systemtic Name: [aminocarbonyl-[1-(1-benzothiophen-2-yl)ethyl]amino] 2-(3-phenyl-1-benzofuran-7-yl)propanoate Openeye Name: [1-(benzothiophen-2-yl)ethyl-carbamoyl-amino] 2-(3-phenylbenzofuran-7-yl)propanoate CAS Name: 2-(3-phenyl-7-benzofuranyl)propanoic acid [1-(1-benzothiophen-2-yl)ethyl-carbamoylamino] ester IUPAC Name: [1-(1-benzothiophen-2-yl)ethyl-carbamoylamino] 2-(3-phenyl-1-benzofuran-7-yl)propanoate Traditional Name: 2-(3-phenylbenzofuran-7-yl)propionic acid [1-(benzothiophen-2-yl)ethyl-carbamoyl-amino] ester Formula: C28H24N2O4S MolecularWeight: 484.56616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=C1OC=C2C3=CC=CC=C3)C(=O)ON(C(C)C4=CC5=CC=CC=C5S4)C(=O)N

Isomeric SMILES

CC(C1=CC=CC2=C1OC=C2C3=CC=CC=C3)C(=O)ON(C(C)C4=CC5=CC=CC=C5S4)C(=O)N

InChI

InChI=1S/C28H24N2O4S/c1-17(21-12-8-13-22-23(16-33-26(21)22)19-9-4-3-5-10-19)27(31)34-30(28(29)32)18(2)25-15-20-11-6-7-14-24(20)35-25/h3-18H,1-2H3,(H2,29,32)