ethyl 2-[3-oxidanylidene-1-[(E)-3-(1-thiophen-3-ylsulfonylindol-3-yl)prop-2-enoyl]piperazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[3-oxidanylidene-1-[(E)-3-(1-thiophen-3-ylsulfonylindol-3-yl)prop-2-enoyl]piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[3-oxo-1-[(E)-3-[1-(3-thienylsulfonyl)indol-3-yl]prop-2-enoyl]piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[(E)-1-oxo-3-[1-(3-thiophenylsulfonyl)-3-indolyl]prop-2-enyl]-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-oxo-1-[(E)-3-(1-thiophen-3-ylsulfonylindol-3-yl)prop-2-enoyl]piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[(E)-3-[1-(3-thienylsulfonyl)indol-3-yl]acryloyl]piperazin-2-yl]acetic acid ethyl ester Formula: C23H23N3O6S2 MolecularWeight: 501.57522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)NCCN1C(=O)C=CC2=CN(C3=CC=CC=C32)S(=O)(=O)C4=CSC=C4

Isomeric SMILES

CCOC(=O)CC1C(=O)NCCN1C(=O)/C=C/C2=CN(C3=CC=CC=C32)S(=O)(=O)C4=CSC=C4

InChI

InChI=1S/C23H23N3O6S2/c1-2-32-22(28)13-20-23(29)24-10-11-25(20)21(27)8-7-16-14-26(19-6-4-3-5-18(16)19)34(30,31)17-9-12-33-15-17/h3-9,12,14-15,20H,2,10-11,13H2,1H3,(H,24,29)/b8-7+