N'-(azepan-1-ylsulfonyl)-N-(4,6-diphenylpyrimidin-2-yl)carbamimidate

Systemtic Name: N'-(azepan-1-ylsulfonyl)-N-(4,6-diphenylpyrimidin-2-yl)carbamimidate Openeye Name: N'-(azepan-1-ylsulfonyl)-N-(4,6-diphenylpyrimidin-2-yl)carbamimidate CAS Name: N'-(1-azepanylsulfonyl)-N-(4,6-diphenyl-2-pyrimidinyl)carbamimidate IUPAC Name: N'-(azepan-1-ylsulfonyl)-N-(4,6-diphenylpyrimidin-2-yl)carbamimidate Traditional Name: N'-(azepan-1-ylsulfonyl)-N-(4,6-diphenylpyrimidin-2-yl)carbamimidate Formula: C23H24N5O3S- MolecularWeight: 450.53336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N=C(NC2=NC(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)[O-]

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N=C(NC2=NC(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C23H25N5O3S/c29-23(27-32(30,31)28-15-9-1-2-10-16-28)26-22-24-20(18-11-5-3-6-12-18)17-21(25-22)19-13-7-4-8-14-19/h3-8,11-14,17H,1-2,9-10,15-16H2,(H2,24,25,26,27,29)/p-1