(E)-4-butylsulfanyl-2-(diphenylmethyl)-2-phenyl-but-3-enenitrile

Systemtic Name: (E)-4-butylsulfanyl-2-(diphenylmethyl)-2-phenyl-but-3-enenitrile Openeye Name: (E)-2-benzhydryl-4-butylsulfanyl-2-phenyl-but-3-enenitrile CAS Name: (E)-4-(butylthio)-2-(diphenylmethyl)-2-phenyl-3-butenenitrile IUPAC Name: (E)-2-benzhydryl-4-butylsulfanyl-2-phenylbut-3-enenitrile Traditional Name: (E)-2-benzhydryl-4-(butylthio)-2-phenyl-but-3-enenitrile Formula: C27H27NS MolecularWeight: 397.57498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC=CC(C#N)(C1=CC=CC=C1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCS/C=C/C(C#N)(C1=CC=CC=C1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H27NS/c1-2-3-20-29-21-19-27(22-28,25-17-11-6-12-18-25)26(23-13-7-4-8-14-23)24-15-9-5-10-16-24/h4-19,21,26H,2-3,20H2,1H3/b21-19+