N-(2-methoxy-1,3-benzothiazol-4-yl)-N-[4-[(E)-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]-4-oxidanylidene-but-2-enoyl]phenoxy]ethanamide

Systemtic Name: N-(2-methoxy-1,3-benzothiazol-4-yl)-N-[4-[(E)-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]-4-oxidanylidene-but-2-enoyl]phenoxy]ethanamide Openeye Name: N-(2-methoxy-1,3-benzothiazol-4-yl)-N-[4-[(E)-4-[4-(4-methylpiperazin-1-yl)-1-piperidyl]-4-oxo-but-2-enoyl]phenoxy]acetamide CAS Name: N-(2-methoxy-1,3-benzothiazol-4-yl)-N-[4-[(E)-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]-1,4-dioxobut-2-enyl]phenoxy]acetamide IUPAC Name: N-(2-methoxy-1,3-benzothiazol-4-yl)-N-[4-[(E)-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]-4-oxobut-2-enoyl]phenoxy]acetamide Traditional Name: N-[4-[(E)-4-keto-4-[4-(4-methylpiperazino)piperidino]but-2-enoyl]phenoxy]-N-(2-methoxy-1,3-benzothiazol-4-yl)acetamide Formula: C30H35N5O5S MolecularWeight: 577.6944

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=C2C(=CC=C1)SC(=N2)OC)OC3=CC=C(C=C3)C(=O)C=CC(=O)N4CCC(CC4)N5CCN(CC5)C

Isomeric SMILES

CC(=O)N(C1=C2C(=CC=C1)SC(=N2)OC)OC3=CC=C(C=C3)C(=O)/C=C/C(=O)N4CCC(CC4)N5CCN(CC5)C

InChI

InChI=1S/C30H35N5O5S/c1-21(36)35(25-5-4-6-27-29(25)31-30(39-3)41-27)40-24-9-7-22(8-10-24)26(37)11-12-28(38)34-15-13-23(14-16-34)33-19-17-32(2)18-20-33/h4-12,23H,13-20H2,1-3H3/b12-11+