2-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-1,3-benzothiazole

Systemtic Name: 2-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-1,3-benzothiazole Openeye Name: 2-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-1,3-benzothiazole CAS Name: 2-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-1,3-benzothiazole IUPAC Name: 2-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-1,3-benzothiazole Traditional Name: 2-[1-(1H-imidazol-5-ylmethyl)-7-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-1,3-benzothiazole Formula: C26H23N5S MolecularWeight: 437.55932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C(CN1C3=NC4=CC=CC=C4S3)C=C(C=C2)C5=CC=CC=C5)CC6=CN=CN6

Isomeric SMILES

C1CN(C2=C(CN1C3=NC4=CC=CC=C4S3)C=C(C=C2)C5=CC=CC=C5)CC6=CN=CN6

InChI

InChI=1S/C26H23N5S/c1-2-6-19(7-3-1)20-10-11-24-21(14-20)16-31(13-12-30(24)17-22-15-27-18-28-22)26-29-23-8-4-5-9-25(23)32-26/h1-11,14-15,18H,12-13,16-17H2,(H,27,28)