1-[5-(azepan-1-ylmethyl)thiophen-2-yl]-1-(2-phenylpropylamino)butan-1-ol

Systemtic Name: 1-[5-(azepan-1-ylmethyl)thiophen-2-yl]-1-(2-phenylpropylamino)butan-1-ol Openeye Name: 1-[5-(azepan-1-ylmethyl)-2-thienyl]-1-(2-phenylpropylamino)butan-1-ol CAS Name: 1-[5-(1-azepanylmethyl)-2-thiophenyl]-1-(2-phenylpropylamino)-1-butanol IUPAC Name: 1-[5-(azepan-1-ylmethyl)thiophen-2-yl]-1-(2-phenylpropylamino)butan-1-ol Traditional Name: 1-[5-(azepan-1-ylmethyl)-2-thienyl]-1-(2-phenylpropylamino)butan-1-ol Formula: C24H36N2OS MolecularWeight: 400.62044

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(S1)CN2CCCCCC2)(NCC(C)C3=CC=CC=C3)O

Isomeric SMILES

CCCC(C1=CC=C(S1)CN2CCCCCC2)(NCC(C)C3=CC=CC=C3)O

InChI

InChI=1S/C24H36N2OS/c1-3-15-24(27,25-18-20(2)21-11-7-6-8-12-21)23-14-13-22(28-23)19-26-16-9-4-5-10-17-26/h6-8,11-14,20,25,27H,3-5,9-10,15-19H2,1-2H3