N-[3-[(3-cyanophenyl)amino]-2-oxidanyl-propyl]-6-sulfanylidene-cyclohexa-1,3-diene-1-carboxamide

Systemtic Name: N-[3-[(3-cyanophenyl)amino]-2-oxidanyl-propyl]-6-sulfanylidene-cyclohexa-1,3-diene-1-carboxamide Openeye Name: N-[3-(3-cyanoanilino)-2-hydroxy-propyl]-6-thioxo-cyclohexa-1,3-diene-1-carboxamide CAS Name: N-[3-(3-cyanoanilino)-2-hydroxypropyl]-6-sulfanylidene-1-cyclohexa-1,3-dienecarboxamide IUPAC Name: N-[3-(3-cyanoanilino)-2-hydroxypropyl]-6-sulfanylidenecyclohexa-1,3-diene-1-carboxamide Traditional Name: N-[3-(3-cyanoanilino)-2-hydroxy-propyl]-6-thioxo-cyclohexa-1,3-diene-1-carboxamide Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=C(C1=S)C(=O)NCC(CNC2=CC=CC(=C2)C#N)O

Isomeric SMILES

C1C=CC=C(C1=S)C(=O)NCC(CNC2=CC=CC(=C2)C#N)O

InChI

InChI=1S/C17H17N3O2S/c18-9-12-4-3-5-13(8-12)19-10-14(21)11-20-17(22)15-6-1-2-7-16(15)23/h1-6,8,14,19,21H,7,10-11H2,(H,20,22)