(E)-3-[3-chloranyl-4-[1-(2-methoxyethyl)indol-5-yl]sulfanyl-phenyl]-1-(4-ethanoylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-[3-chloranyl-4-[1-(2-methoxyethyl)indol-5-yl]sulfanyl-phenyl]-1-(4-ethanoylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-acetylpiperazin-1-yl)-3-[3-chloro-4-[1-(2-methoxyethyl)indol-5-yl]sulfanyl-phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-acetyl-1-piperazinyl)-3-[3-chloro-4-[[1-(2-methoxyethyl)-5-indolyl]thio]phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-acetylpiperazin-1-yl)-3-[3-chloro-4-[1-(2-methoxyethyl)indol-5-yl]sulfanylphenyl]prop-2-en-1-one Traditional Name: (E)-1-(4-acetylpiperazino)-3-[3-chloro-4-[[1-(2-methoxyethyl)indol-5-yl]thio]phenyl]prop-2-en-1-one Formula: C26H28ClN3O3S MolecularWeight: 498.03682

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C=CC2=CC(=C(C=C2)SC3=CC4=C(C=C3)N(C=C4)CCOC)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)/C=C/C2=CC(=C(C=C2)SC3=CC4=C(C=C3)N(C=C4)CCOC)Cl

InChI

InChI=1S/C26H28ClN3O3S/c1-19(31)28-11-13-30(14-12-28)26(32)8-4-20-3-7-25(23(27)17-20)34-22-5-6-24-21(18-22)9-10-29(24)15-16-33-2/h3-10,17-18H,11-16H2,1-2H3/b8-4+