azepan-1-yl-[1-[3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[3-(1,3-benzothiazol-2-yl)pyrazine-2-carbonyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[3-(1,3-benzothiazol-2-yl)-2-pyrazinyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[3-(1,3-benzothiazol-2-yl)pyrazine-2-carbonyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[3-(1,3-benzothiazol-2-yl)pyrazinoyl]-4-piperidyl]methanone Formula: C24H27N5O2S MolecularWeight: 449.56848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H27N5O2S/c30-23(28-13-5-1-2-6-14-28)17-9-15-29(16-10-17)24(31)21-20(25-11-12-26-21)22-27-18-7-3-4-8-19(18)32-22/h3-4,7-8,11-12,17H,1-2,5-6,9-10,13-16H2