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

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-morpholinosulfonyl-benzamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-morpholinosulfonyl-benzamide Formula: C23H31N5O5S MolecularWeight: 489.58774

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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)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H31N5O5S/c29-23(19-5-7-20(8-6-19)34(30,31)28-12-15-32-16-13-28)24-9-14-33-22-17-21(25-18-26-22)27-10-3-1-2-4-11-27/h5-8,17-18H,1-4,9-16H2,(H,24,29)