N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-piperidinosulfonyl-benzamide Formula: C24H33N5O4S MolecularWeight: 487.61492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C24H33N5O4S/c30-24(20-8-10-21(11-9-20)34(31,32)29-15-6-3-7-16-29)25-12-17-33-23-18-22(26-19-27-23)28-13-4-1-2-5-14-28/h8-11,18-19H,1-7,12-17H2,(H,25,30)