S-(3-phenylpropyl) 4-(phenylazanylmethyl)benzenecarbothioate

Systemtic Name: S-(3-phenylpropyl) 4-(phenylazanylmethyl)benzenecarbothioate Openeye Name: S-(3-phenylpropyl) 4-(anilinomethyl)benzenecarbothioate CAS Name: 4-(anilinomethyl)benzenecarbothioic acid S-(3-phenylpropyl) ester IUPAC Name: S-(3-phenylpropyl) 4-(anilinomethyl)benzenecarbothioate Traditional Name: 4-(anilinomethyl)thiobenzoic acid S-(3-phenylpropyl) ester Formula: C23H23NOS MolecularWeight: 361.49982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCSC(=O)C2=CC=C(C=C2)CNC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCSC(=O)C2=CC=C(C=C2)CNC3=CC=CC=C3

InChI

InChI=1S/C23H23NOS/c25-23(26-17-7-10-19-8-3-1-4-9-19)21-15-13-20(14-16-21)18-24-22-11-5-2-6-12-22/h1-6,8-9,11-16,24H,7,10,17-18H2