7-bromanyl-1-methyl-5-phenyl-3H-thieno[2,3-e][1,4]diazepin-2-one

Systemtic Name: 7-bromanyl-1-methyl-5-phenyl-3H-thieno[2,3-e][1,4]diazepin-2-one Openeye Name: 7-bromo-1-methyl-5-phenyl-3H-thieno[2,3-e][1,4]diazepin-2-one CAS Name: 7-bromo-1-methyl-5-phenyl-3H-thieno[2,3-e][1,4]diazepin-2-one IUPAC Name: 7-bromo-1-methyl-5-phenyl-3H-thieno[2,3-e][1,4]diazepin-2-one Traditional Name: 7-bromo-1-methyl-5-phenyl-3H-thieno[2,3-e][1,4]diazepin-2-one Formula: C14H11BrN2OS MolecularWeight: 335.21894

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN=C(C2=C1SC(=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CN1C(=O)CN=C(C2=C1SC(=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C14H11BrN2OS/c1-17-12(18)8-16-13(9-5-3-2-4-6-9)10-7-11(15)19-14(10)17/h2-7H,8H2,1H3