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

Systemtic Name: 2-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-5-[(phenylmethyl)amino]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(benzylamino)-2-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]oxazole-4-carbonitrile CAS Name: 2-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-5-[(phenylmethyl)amino]-4-oxazolecarbonitrile IUPAC Name: 5-(benzylamino)-2-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(benzylamino)-2-[4-(3-methylpiperidino)sulfonylphenyl]oxazole-4-carbonitrile Formula: C23H24N4O3S MolecularWeight: 436.52666

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)NCC4=CC=CC=C4)C#N

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)NCC4=CC=CC=C4)C#N

InChI

InChI=1S/C23H24N4O3S/c1-17-6-5-13-27(16-17)31(28,29)20-11-9-19(10-12-20)22-26-21(14-24)23(30-22)25-15-18-7-3-2-4-8-18/h2-4,7-12,17,25H,5-6,13,15-16H2,1H3