(3S)-4-naphthalen-2-ylsulfonyl-3-phenyl-N-[(4R)-7-(piperidin-1-ylmethyl)-3,4-dihydro-2H-chromen-4-yl]butanamide

Systemtic Name: (3S)-4-naphthalen-2-ylsulfonyl-3-phenyl-N-[(4R)-7-(piperidin-1-ylmethyl)-3,4-dihydro-2H-chromen-4-yl]butanamide Openeye Name: (3S)-4-(2-naphthylsulfonyl)-3-phenyl-N-[(4R)-7-(1-piperidylmethyl)chroman-4-yl]butanamide CAS Name: (3S)-4-(2-naphthalenylsulfonyl)-3-phenyl-N-[(4R)-7-(1-piperidinylmethyl)-3,4-dihydro-2H-1-benzopyran-4-yl]butanamide IUPAC Name: (3S)-4-naphthalen-2-ylsulfonyl-3-phenyl-N-[(4R)-7-(piperidin-1-ylmethyl)-3,4-dihydro-2H-chromen-4-yl]butanamide Traditional Name: (3S)-4-(2-naphthylsulfonyl)-3-phenyl-N-[(4R)-7-(piperidinomethyl)chroman-4-yl]butyramide Formula: C35H38N2O4S MolecularWeight: 582.75222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC3=C(C=C2)C(CCO3)NC(=O)CC(CS(=O)(=O)C4=CC5=CC=CC=C5C=C4)C6=CC=CC=C6

Isomeric SMILES

C1CCN(CC1)CC2=CC3=C(C=C2)[C@@H](CCO3)NC(=O)C[C@H](CS(=O)(=O)C4=CC5=CC=CC=C5C=C4)C6=CC=CC=C6

InChI

InChI=1S/C35H38N2O4S/c38-35(36-33-17-20-41-34-21-26(13-16-32(33)34)24-37-18-7-2-8-19-37)23-30(27-9-3-1-4-10-27)25-42(39,40)31-15-14-28-11-5-6-12-29(28)22-31/h1,3-6,9-16,21-22,30,33H,2,7-8,17-20,23-25H2,(H,36,38)/t30-,33-/m1/s1