(E)-3-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one Openeye Name: (E)-3-[4-methoxy-3-(thiomorpholinomethyl)phenyl]-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one CAS Name: (E)-3-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]-1-[4-(1-pyrrolyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-[4-methoxy-3-(thiomorpholinomethyl)phenyl]-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one Formula: C25H26N2O2S MolecularWeight: 418.55114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)N3C=CC=C3)CN4CCSCC4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)N3C=CC=C3)CN4CCSCC4

InChI

InChI=1S/C25H26N2O2S/c1-29-25-11-5-20(18-22(25)19-26-14-16-30-17-15-26)4-10-24(28)21-6-8-23(9-7-21)27-12-2-3-13-27/h2-13,18H,14-17,19H2,1H3/b10-4+