(2S)-N-(6-azanylhexyl)-2-[(5-chloranylnaphthalen-1-yl)sulfonylamino]-3-phenyl-propanamide

Systemtic Name: (2S)-N-(6-azanylhexyl)-2-[(5-chloranylnaphthalen-1-yl)sulfonylamino]-3-phenyl-propanamide Openeye Name: (2S)-N-(6-aminohexyl)-2-[(5-chloro-1-naphthyl)sulfonylamino]-3-phenyl-propanamide CAS Name: (2S)-N-(6-aminohexyl)-2-[(5-chloro-1-naphthalenyl)sulfonylamino]-3-phenylpropanamide IUPAC Name: (2S)-N-(6-aminohexyl)-2-[(5-chloronaphthalen-1-yl)sulfonylamino]-3-phenylpropanamide Traditional Name: (2S)-N-(6-aminohexyl)-2-[(5-chloro-1-naphthyl)sulfonylamino]-3-phenyl-propionamide Formula: C25H30ClN3O3S MolecularWeight: 488.042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCCCCCCN)NS(=O)(=O)C2=CC=CC3=C2C=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NCCCCCCN)NS(=O)(=O)C2=CC=CC3=C2C=CC=C3Cl

InChI

InChI=1S/C25H30ClN3O3S/c26-22-14-8-13-21-20(22)12-9-15-24(21)33(31,32)29-23(18-19-10-4-3-5-11-19)25(30)28-17-7-2-1-6-16-27/h3-5,8-15,23,29H,1-2,6-7,16-18,27H2,(H,28,30)/t23-/m0/s1