4-[(4-tert-butylphenyl)methyl]-2,3-dihydrothieno[3,2-f][1,4]thiazepin-5-one

Systemtic Name: 4-[(4-tert-butylphenyl)methyl]-2,3-dihydrothieno[3,2-f][1,4]thiazepin-5-one Openeye Name: 4-[(4-tert-butylphenyl)methyl]-2,3-dihydrothieno[3,2-f][1,4]thiazepin-5-one CAS Name: 4-[(4-tert-butylphenyl)methyl]-2,3-dihydrothieno[3,2-f][1,4]thiazepin-5-one IUPAC Name: 4-[(4-tert-butylphenyl)methyl]-2,3-dihydrothieno[3,2-f][1,4]thiazepin-5-one Traditional Name: 4-(4-tert-butylbenzyl)-2,3-dihydrothieno[3,2-f][1,4]thiazepin-5-one Formula: C18H21NOS2 MolecularWeight: 331.49544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCSC3=C(C2=O)C=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCSC3=C(C2=O)C=CS3

InChI

InChI=1S/C18H21NOS2/c1-18(2,3)14-6-4-13(5-7-14)12-19-9-11-22-17-15(16(19)20)8-10-21-17/h4-8,10H,9,11-12H2,1-3H3