5-(3-methoxypropylamino)-2-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(3-methoxypropylamino)-2-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(3-methoxypropylamino)-2-[4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenyl]oxazole-4-carbonitrile CAS Name: 5-(3-methoxypropylamino)-2-[4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenyl]-4-oxazolecarbonitrile IUPAC Name: 5-(3-methoxypropylamino)-2-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(3-methoxypropylamino)-2-[4-[(3S)-3-methylpiperidino]sulfonylphenyl]oxazole-4-carbonitrile Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)NCCCOC)C#N

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)NCCCOC)C#N

InChI

InChI=1S/C20H26N4O4S/c1-15-5-3-11-24(14-15)29(25,26)17-8-6-16(7-9-17)19-23-18(13-21)20(28-19)22-10-4-12-27-2/h6-9,15,22H,3-5,10-12,14H2,1-2H3/t15-/m0/s1