4-methoxy-N-[(E,1S)-4-[(3R)-1-(4-methylphenyl)sulfonyl-4-propan-2-ylidene-pyrrolidin-3-yl]-1-phenyl-but-3-enyl]aniline

Systemtic Name: 4-methoxy-N-[(E,1S)-4-[(3R)-1-(4-methylphenyl)sulfonyl-4-propan-2-ylidene-pyrrolidin-3-yl]-1-phenyl-but-3-enyl]aniline Openeye Name: N-[(E,1S)-4-[(3R)-4-isopropylidene-1-(p-tolylsulfonyl)pyrrolidin-3-yl]-1-phenyl-but-3-enyl]-4-methoxy-aniline CAS Name: 4-methoxy-N-[(E,1S)-4-[(3R)-1-(4-methylphenyl)sulfonyl-4-propan-2-ylidene-3-pyrrolidinyl]-1-phenylbut-3-enyl]aniline IUPAC Name: 4-methoxy-N-[(E,1S)-4-[(3R)-1-(4-methylphenyl)sulfonyl-4-propan-2-ylidenepyrrolidin-3-yl]-1-phenylbut-3-enyl]aniline Traditional Name: [(E,1S)-4-[(3R)-4-isopropylidene-1-tosyl-pyrrolidin-3-yl]-1-phenyl-but-3-enyl]-(4-methoxyphenyl)amine Formula: C31H36N2O3S MolecularWeight: 516.69414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C(=C(C)C)C2)C=CCC(C3=CC=CC=C3)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H](C(=C(C)C)C2)/C=C/C[C@@H](C3=CC=CC=C3)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C31H36N2O3S/c1-23(2)30-22-33(37(34,35)29-19-13-24(3)14-20-29)21-26(30)11-8-12-31(25-9-6-5-7-10-25)32-27-15-17-28(36-4)18-16-27/h5-11,13-20,26,31-32H,12,21-22H2,1-4H3/b11-8+/t26-,31-/m0/s1