S-[(1R,3S)-3-[(diphenylmethyl)amino]-1-phenyl-hex-5-enyl] ethanethioate

Systemtic Name: S-[(1R,3S)-3-[(diphenylmethyl)amino]-1-phenyl-hex-5-enyl] ethanethioate Openeye Name: S-[(1R,3S)-3-(benzhydrylamino)-1-phenyl-hex-5-enyl] ethanethioate CAS Name: ethanethioic acid S-[(1R,3S)-3-[(diphenylmethyl)amino]-1-phenylhex-5-enyl] ester IUPAC Name: S-[(1R,3S)-3-(benzhydrylamino)-1-phenylhex-5-enyl] ethanethioate Traditional Name: ethanethioic acid S-[(1R,3S)-3-(benzhydrylamino)-1-phenyl-hex-5-enyl] ester Formula: C27H29NOS MolecularWeight: 415.59026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC(CC=C)NC(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)S[C@H](C[C@H](CC=C)NC(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H29NOS/c1-3-13-25(20-26(30-21(2)29)22-14-7-4-8-15-22)28-27(23-16-9-5-10-17-23)24-18-11-6-12-19-24/h3-12,14-19,25-28H,1,13,20H2,2H3/t25-,26+/m0/s1