N'-[2,5-bis(bromanyl)phenyl]-3,4-dihydro-2H-1,5-benzothiazepine-5-carboximidamide

Systemtic Name: N'-[2,5-bis(bromanyl)phenyl]-3,4-dihydro-2H-1,5-benzothiazepine-5-carboximidamide Openeye Name: N'-(2,5-dibromophenyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxamidine CAS Name: N'-(2,5-dibromophenyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboximidamide IUPAC Name: N'-(2,5-dibromophenyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboximidamide Traditional Name: N'-(2,5-dibromophenyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxamidine Formula: C16H15Br2N3S MolecularWeight: 441.1834

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=NC3=C(C=CC(=C3)Br)Br)N

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=NC3=C(C=CC(=C3)Br)Br)N

InChI

InChI=1S/C16H15Br2N3S/c17-11-6-7-12(18)13(10-11)20-16(19)21-8-3-9-22-15-5-2-1-4-14(15)21/h1-2,4-7,10H,3,8-9H2,(H2,19,20)