1-(azepan-1-yl)-2-[4-[3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[4-[3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[4-[3-(1,3-benzothiazol-2-yl)pyrazine-2-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[4-[[3-(1,3-benzothiazol-2-yl)-2-pyrazinyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[4-[3-(1,3-benzothiazol-2-yl)pyrazine-2-carbonyl]piperazin-1-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[4-[3-(1,3-benzothiazol-2-yl)pyrazinoyl]piperazino]ethanone Formula: C24H28N6O2S MolecularWeight: 464.58312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2CCN(CC2)C(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2CCN(CC2)C(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H28N6O2S/c31-20(29-11-5-1-2-6-12-29)17-28-13-15-30(16-14-28)24(32)22-21(25-9-10-26-22)23-27-18-7-3-4-8-19(18)33-23/h3-4,7-10H,1-2,5-6,11-17H2