(E)-3-(1-naphthalen-1-ylsulfonylindol-3-yl)-1-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(1-naphthalen-1-ylsulfonylindol-3-yl)-1-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-[1-(1-naphthylsulfonyl)indol-3-yl]-1-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-[1-(1-naphthalenylsulfonyl)-3-indolyl]-1-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(1-naphthalen-1-ylsulfonylindol-3-yl)-1-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-1-[4-(2-keto-2-pyrrolidino-ethyl)piperazino]-3-[1-(1-naphthylsulfonyl)indol-3-yl]prop-2-en-1-one Formula: C31H32N4O4S MolecularWeight: 556.67518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)C(=O)C=CC3=CN(C4=CC=CC=C43)S(=O)(=O)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)C(=O)/C=C/C3=CN(C4=CC=CC=C43)S(=O)(=O)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C31H32N4O4S/c36-30(34-20-18-32(19-21-34)23-31(37)33-16-5-6-17-33)15-14-25-22-35(28-12-4-3-10-26(25)28)40(38,39)29-13-7-9-24-8-1-2-11-27(24)29/h1-4,7-15,22H,5-6,16-21,23H2/b15-14+