N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]-3-(phenylcarbamoylamino)propanamide

Systemtic Name: N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]-3-(phenylcarbamoylamino)propanamide Openeye Name: N-[4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenyl]-3-(phenylcarbamoylamino)propanamide CAS Name: 3-[[anilino(oxo)methyl]amino]-N-[4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenyl]propanamide IUPAC Name: N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]-3-(phenylcarbamoylamino)propanamide Traditional Name: N-[4-[(3S)-3-methylpiperidino]sulfonylphenyl]-3-(phenylcarbamoylamino)propionamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCNC(=O)NC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O4S/c1-17-6-5-15-26(16-17)31(29,30)20-11-9-19(10-12-20)24-21(27)13-14-23-22(28)25-18-7-3-2-4-8-18/h2-4,7-12,17H,5-6,13-16H2,1H3,(H,24,27)(H2,23,25,28)/t17-/m0/s1