3-chloranyl-N-[3-[3-[di(propan-2-yl)amino]propyl]-4-methoxy-phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[3-[3-[di(propan-2-yl)amino]propyl]-4-methoxy-phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[3-[3-(diisopropylamino)propyl]-4-methoxy-phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[3-[3-[di(propan-2-yl)amino]propyl]-4-methoxyphenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[3-[3-[di(propan-2-yl)amino]propyl]-4-methoxyphenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[3-[3-(diisopropylamino)propyl]-4-methoxy-phenyl]benzothiophene-2-carboxamide Formula: C25H31ClN2O2S MolecularWeight: 459.04384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCCC1=C(C=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)OC)C(C)C

Isomeric SMILES

CC(C)N(CCCC1=C(C=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)OC)C(C)C

InChI

InChI=1S/C25H31ClN2O2S/c1-16(2)28(17(3)4)14-8-9-18-15-19(12-13-21(18)30-5)27-25(29)24-23(26)20-10-6-7-11-22(20)31-24/h6-7,10-13,15-17H,8-9,14H2,1-5H3,(H,27,29)