N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide Formula: C17H26N6O3S MolecularWeight: 394.49174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3

InChI

InChI=1S/C17H26N6O3S/c1-13-17(14(2)22-21-13)27(24,25)20-7-10-26-16-11-15(18-12-19-16)23-8-5-3-4-6-9-23/h11-12,20H,3-10H2,1-2H3,(H,21,22)