(5-azanyl-3-butyl-1-benzothiophen-2-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone

Systemtic Name: (5-azanyl-3-butyl-1-benzothiophen-2-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone Openeye Name: (5-amino-3-butyl-benzothiophen-2-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone CAS Name: (5-amino-3-butyl-1-benzothiophen-2-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone IUPAC Name: (5-amino-3-butyl-1-benzothiophen-2-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone Traditional Name: (5-amino-3-butyl-benzothiophen-2-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone Formula: C30H42N2O2S MolecularWeight: 494.73168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(SC2=C1C=C(C=C2)N)C(=O)C3=CC=C(C=C3)OCCCN(CCCC)CCCC

Isomeric SMILES

CCCCC1=C(SC2=C1C=C(C=C2)N)C(=O)C3=CC=C(C=C3)OCCCN(CCCC)CCCC

InChI

InChI=1S/C30H42N2O2S/c1-4-7-11-26-27-22-24(31)14-17-28(27)35-30(26)29(33)23-12-15-25(16-13-23)34-21-10-20-32(18-8-5-2)19-9-6-3/h12-17,22H,4-11,18-21,31H2,1-3H3