3-azanyl-5-phenyl-1-(2H-1,2,3,4-tetrazol-5-ylmethyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-5-phenyl-1-(2H-1,2,3,4-tetrazol-5-ylmethyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-5-phenyl-1-(2H-tetrazol-5-ylmethyl)-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-5-phenyl-1-(2H-tetrazol-5-ylmethyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-5-phenyl-1-(2H-tetrazol-5-ylmethyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-5-phenyl-1-(2H-tetrazol-5-ylmethyl)-3H-1,4-benzodiazepin-2-one Formula: C17H15N7O MolecularWeight: 333.3473

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=CC=CC=C32)CC4=NNN=N4)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=CC=CC=C32)CC4=NNN=N4)N

InChI

InChI=1S/C17H15N7O/c18-16-17(25)24(10-14-20-22-23-21-14)13-9-5-4-8-12(13)15(19-16)11-6-2-1-3-7-11/h1-9,16H,10,18H2,(H,20,21,22,23)