tert-butyl N-[1-[4-azanyl-3-(naphthalen-1-ylsulfonylmethyl)phenyl]piperidin-4-yl]carbamate

Systemtic Name: tert-butyl N-[1-[4-azanyl-3-(naphthalen-1-ylsulfonylmethyl)phenyl]piperidin-4-yl]carbamate Openeye Name: tert-butyl N-[1-[4-amino-3-(1-naphthylsulfonylmethyl)phenyl]-4-piperidyl]carbamate CAS Name: N-[1-[4-amino-3-(1-naphthalenylsulfonylmethyl)phenyl]-4-piperidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[4-amino-3-(naphthalen-1-ylsulfonylmethyl)phenyl]piperidin-4-yl]carbamate Traditional Name: N-[1-[4-amino-3-(1-naphthylsulfonylmethyl)phenyl]-4-piperidyl]carbamic acid tert-butyl ester Formula: C27H33N3O4S MolecularWeight: 495.63362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(CC1)C2=CC(=C(C=C2)N)CS(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(CC1)C2=CC(=C(C=C2)N)CS(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H33N3O4S/c1-27(2,3)34-26(31)29-21-13-15-30(16-14-21)22-11-12-24(28)20(17-22)18-35(32,33)25-10-6-8-19-7-4-5-9-23(19)25/h4-12,17,21H,13-16,18,28H2,1-3H3,(H,29,31)