N-[2-[(E)-2-bromanylprop-1-enyl]-3-ethenyl-1H-2,4-benzodiazepin-5-ylidene]thiophene-2-carboxamide

Systemtic Name: N-[2-[(E)-2-bromanylprop-1-enyl]-3-ethenyl-1H-2,4-benzodiazepin-5-ylidene]thiophene-2-carboxamide Openeye Name: N-[2-[(E)-2-bromoprop-1-enyl]-3-vinyl-1H-2,4-benzodiazepin-5-ylidene]thiophene-2-carboxamide CAS Name: N-[2-[(E)-2-bromoprop-1-enyl]-3-ethenyl-1H-2,4-benzodiazepin-5-ylidene]-2-thiophenecarboxamide IUPAC Name: N-[2-[(E)-2-bromoprop-1-enyl]-3-ethenyl-1H-2,4-benzodiazepin-5-ylidene]thiophene-2-carboxamide Traditional Name: N-[2-[(E)-2-bromoprop-1-enyl]-3-vinyl-1H-2,4-benzodiazepin-5-ylidene]thiophene-2-carboxamide Formula: C19H16BrN3OS MolecularWeight: 414.31884

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CN1CC2=CC=CC=C2C(=NC(=O)C3=CC=CS3)N=C1C=C)Br

Isomeric SMILES

C/C(=C\N1CC2=CC=CC=C2C(=NC(=O)C3=CC=CS3)N=C1C=C)/Br

InChI

InChI=1S/C19H16BrN3OS/c1-3-17-21-18(22-19(24)16-9-6-10-25-16)15-8-5-4-7-14(15)12-23(17)11-13(2)20/h3-11H,1,12H2,2H3/b13-11+,22-18?