4-[3-(1,2-dihydro-1,2,3-triazol-3-yl)phenyl]-8-pyrrolidin-1-yl-1,5-benzodiazepin-2-one

Systemtic Name: 4-[3-(1,2-dihydro-1,2,3-triazol-3-yl)phenyl]-8-pyrrolidin-1-yl-1,5-benzodiazepin-2-one Openeye Name: 4-[3-(1,2-dihydrotriazol-3-yl)phenyl]-8-pyrrolidin-1-yl-1,5-benzodiazepin-2-one CAS Name: 4-[3-(1,2-dihydrotriazol-3-yl)phenyl]-8-(1-pyrrolidinyl)-1,5-benzodiazepin-2-one IUPAC Name: 4-[3-(1,2-dihydrotriazol-3-yl)phenyl]-8-pyrrolidin-1-yl-1,5-benzodiazepin-2-one Traditional Name: 4-[3-(1,2-dihydrotriazol-3-yl)phenyl]-8-pyrrolidino-1,5-benzodiazepin-2-one Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC3=NC(=O)C=C(N=C3C=C2)C4=CC(=CC=C4)N5C=CNN5

Isomeric SMILES

C1CCN(C1)C2=CC3=NC(=O)C=C(N=C3C=C2)C4=CC(=CC=C4)N5C=CNN5

InChI

InChI=1S/C21H20N6O/c28-21-14-19(15-4-3-5-17(12-15)27-11-8-22-25-27)23-18-7-6-16(13-20(18)24-21)26-9-1-2-10-26/h3-8,11-14,22,25H,1-2,9-10H2