(6-chloranylpyridin-3-yl)-[6-methoxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methanone

Systemtic Name: (6-chloranylpyridin-3-yl)-[6-methoxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methanone Openeye Name: (6-chloro-3-pyridyl)-[6-methoxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzothiophen-3-yl]methanone CAS Name: (6-chloro-3-pyridinyl)-[6-methoxy-2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1-benzothiophen-3-yl]methanone IUPAC Name: (6-chloropyridin-3-yl)-[6-methoxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methanone Traditional Name: (6-chloro-3-pyridyl)-[6-methoxy-2-[4-(2-pyrrolidinoethoxy)phenyl]benzothiophen-3-yl]methanone Formula: C27H25ClN2O3S MolecularWeight: 493.017

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)OCCN4CCCC4)C(=O)C5=CN=C(C=C5)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)OCCN4CCCC4)C(=O)C5=CN=C(C=C5)Cl

InChI

InChI=1S/C27H25ClN2O3S/c1-32-21-9-10-22-23(16-21)34-27(25(22)26(31)19-6-11-24(28)29-17-19)18-4-7-20(8-5-18)33-15-14-30-12-2-3-13-30/h4-11,16-17H,2-3,12-15H2,1H3