ethyl 2-[[4-(1-benzothiophen-2-yl)-3-(4-phenylphenyl)butan-2-yl]amino]ethanoate

Systemtic Name: ethyl 2-[[4-(1-benzothiophen-2-yl)-3-(4-phenylphenyl)butan-2-yl]amino]ethanoate Openeye Name: ethyl 2-[[3-(benzothiophen-2-yl)-1-methyl-2-(4-phenylphenyl)propyl]amino]acetate CAS Name: 2-[[4-(1-benzothiophen-2-yl)-3-(4-phenylphenyl)butan-2-yl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-(1-benzothiophen-2-yl)-3-(4-phenylphenyl)butan-2-yl]amino]acetate Traditional Name: 2-[[3-(benzothiophen-2-yl)-1-methyl-2-(4-phenylphenyl)propyl]amino]acetic acid ethyl ester Formula: C28H29NO2S MolecularWeight: 443.60036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(C)C(CC1=CC2=CC=CC=C2S1)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CNC(C)C(CC1=CC2=CC=CC=C2S1)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H29NO2S/c1-3-31-28(30)19-29-20(2)26(18-25-17-24-11-7-8-12-27(24)32-25)23-15-13-22(14-16-23)21-9-5-4-6-10-21/h4-17,20,26,29H,3,18-19H2,1-2H3