4-[2-(1-benzothiophen-5-yl)ethoxy]-1-[(phenylmethyl)amino]butan-2-ol

Systemtic Name: 4-[2-(1-benzothiophen-5-yl)ethoxy]-1-[(phenylmethyl)amino]butan-2-ol Openeye Name: 4-[2-(benzothiophen-5-yl)ethoxy]-1-(benzylamino)butan-2-ol CAS Name: 4-[2-(1-benzothiophen-5-yl)ethoxy]-1-[(phenylmethyl)amino]-2-butanol IUPAC Name: 4-[2-(1-benzothiophen-5-yl)ethoxy]-1-(benzylamino)butan-2-ol Traditional Name: 4-[2-(benzothiophen-5-yl)ethoxy]-1-(benzylamino)butan-2-ol Formula: C21H25NO2S MolecularWeight: 355.4937

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC(CCOCCC2=CC3=C(C=C2)SC=C3)O

Isomeric SMILES

C1=CC=C(C=C1)CNCC(CCOCCC2=CC3=C(C=C2)SC=C3)O

InChI

InChI=1S/C21H25NO2S/c23-20(16-22-15-18-4-2-1-3-5-18)9-12-24-11-8-17-6-7-21-19(14-17)10-13-25-21/h1-7,10,13-14,20,22-23H,8-9,11-12,15-16H2