6-(phenylmethyl)-4H-1,4-thiazepin-5-one

Systemtic Name: 6-(phenylmethyl)-4H-1,4-thiazepin-5-one Openeye Name: 6-benzyl-4H-1,4-thiazepin-5-one CAS Name: 6-(phenylmethyl)-4H-1,4-thiazepin-5-one IUPAC Name: 6-benzyl-4H-1,4-thiazepin-5-one Traditional Name: 6-benzyl-4H-1,4-thiazepin-5-one Formula: C12H11NOS MolecularWeight: 217.28684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CSC=CNC2=O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CSC=CNC2=O

InChI

InChI=1S/C12H11NOS/c14-12-11(9-15-7-6-13-12)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,13,14)