2-[4-(3-oxidanylpropyl)phenyl]benzenecarbothioamide

Systemtic Name: 2-[4-(3-oxidanylpropyl)phenyl]benzenecarbothioamide Openeye Name: 2-[4-(3-hydroxypropyl)phenyl]benzenecarbothioamide CAS Name: 2-[4-(3-hydroxypropyl)phenyl]benzenecarbothioamide IUPAC Name: 2-[4-(3-hydroxypropyl)phenyl]benzenecarbothioamide Traditional Name: 2-[4-(3-hydroxypropyl)phenyl]thiobenzamide Formula: C16H17NOS MolecularWeight: 271.37728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)CCCO)C(=S)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)CCCO)C(=S)N

InChI

InChI=1S/C16H17NOS/c17-16(19)15-6-2-1-5-14(15)13-9-7-12(8-10-13)4-3-11-18/h1-2,5-10,18H,3-4,11H2,(H2,17,19)