2-(thiophen-2-ylmethyl)-5H-1,5-benzothiazepin-4-one

Systemtic Name: 2-(thiophen-2-ylmethyl)-5H-1,5-benzothiazepin-4-one Openeye Name: 2-(2-thienylmethyl)-5H-1,5-benzothiazepin-4-one CAS Name: 2-(thiophen-2-ylmethyl)-5H-1,5-benzothiazepin-4-one IUPAC Name: 2-(thiophen-2-ylmethyl)-5H-1,5-benzothiazepin-4-one Traditional Name: 2-(2-thenyl)-5H-1,5-benzothiazepin-4-one Formula: C14H11NOS2 MolecularWeight: 273.37324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C=C(S2)CC3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C=C(S2)CC3=CC=CS3

InChI

InChI=1S/C14H11NOS2/c16-14-9-11(8-10-4-3-7-17-10)18-13-6-2-1-5-12(13)15-14/h1-7,9H,8H2,(H,15,16)