1-methyl-3-(6-phenylpyridin-3-yl)-1-(1-propan-2-ylsulfonylpiperidin-4-yl)urea

Systemtic Name: 1-methyl-3-(6-phenylpyridin-3-yl)-1-(1-propan-2-ylsulfonylpiperidin-4-yl)urea Openeye Name: 1-(1-isopropylsulfonyl-4-piperidyl)-1-methyl-3-(6-phenyl-3-pyridyl)urea CAS Name: 1-methyl-3-(6-phenyl-3-pyridinyl)-1-(1-propan-2-ylsulfonyl-4-piperidinyl)urea IUPAC Name: 1-methyl-3-(6-phenylpyridin-3-yl)-1-(1-propan-2-ylsulfonylpiperidin-4-yl)urea Traditional Name: 1-(1-isopropylsulfonyl-4-piperidyl)-1-methyl-3-(6-phenyl-3-pyridyl)urea Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1CCC(CC1)N(C)C(=O)NC2=CN=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)S(=O)(=O)N1CCC(CC1)N(C)C(=O)NC2=CN=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H28N4O3S/c1-16(2)29(27,28)25-13-11-19(12-14-25)24(3)21(26)23-18-9-10-20(22-15-18)17-7-5-4-6-8-17/h4-10,15-16,19H,11-14H2,1-3H3,(H,23,26)