5-bromanyl-N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)thiophene-2-carboxamide

Systemtic Name: 5-bromanyl-N-(2-iodanyl-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)thiophene-2-carboxamide Openeye Name: 5-bromo-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)thiophene-2-carboxamide CAS Name: 5-bromo-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-2-thiophenecarboxamide IUPAC Name: 5-bromo-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)thiophene-2-carboxamide Traditional Name: 5-bromo-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)thiophene-2-carboxamide Formula: C18H11BrIN3OS MolecularWeight: 524.17291

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=NC(=O)C3=CC=C(S3)Br)N=C4N1C=C(C=C4)I

Isomeric SMILES

C1C2=CC=CC=C2C(=NC(=O)C3=CC=C(S3)Br)N=C4N1C=C(C=C4)I

InChI

InChI=1S/C18H11BrIN3OS/c19-15-7-6-14(25-15)18(24)22-17-13-4-2-1-3-11(13)9-23-10-12(20)5-8-16(23)21-17/h1-8,10H,9H2