3-methyl-5-phenylazanyl-1,4-thiazepin-6-one

Systemtic Name: 3-methyl-5-phenylazanyl-1,4-thiazepin-6-one Openeye Name: 5-anilino-3-methyl-1,4-thiazepin-6-one CAS Name: 5-anilino-3-methyl-1,4-thiazepin-6-one IUPAC Name: 5-anilino-3-methyl-1,4-thiazepin-6-one Traditional Name: 5-anilino-3-methyl-1,4-thiazepin-6-one Formula: C12H12N2OS MolecularWeight: 232.30148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSCC(=O)C(=N1)NC2=CC=CC=C2

Isomeric SMILES

CC1=CSCC(=O)C(=N1)NC2=CC=CC=C2

InChI

InChI=1S/C12H12N2OS/c1-9-7-16-8-11(15)12(13-9)14-10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,13,14)