1,3-dimethyl-4-phenyl-N-prop-2-ynyl-6H-pyrazolo[3,4-e][1,4]diazepin-7-amine

Systemtic Name: 1,3-dimethyl-4-phenyl-N-prop-2-ynyl-6H-pyrazolo[3,4-e][1,4]diazepin-7-amine Openeye Name: 1,3-dimethyl-4-phenyl-N-prop-2-ynyl-6H-pyrazolo[3,4-e][1,4]diazepin-7-amine CAS Name: 1,3-dimethyl-4-phenyl-N-prop-2-ynyl-6H-pyrazolo[3,4-e][1,4]diazepin-7-amine IUPAC Name: 1,3-dimethyl-4-phenyl-N-prop-2-ynyl-6H-pyrazolo[3,4-e][1,4]diazepin-7-amine Traditional Name: (1,3-dimethyl-4-phenyl-6H-pyrazolo[3,4-e][1,4]diazepin-7-yl)-propargyl-amine Formula: C17H17N5 MolecularWeight: 291.35038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=NCC(=N2)NCC#C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=NN(C2=C1C(=NCC(=N2)NCC#C)C3=CC=CC=C3)C

InChI

InChI=1S/C17H17N5/c1-4-10-18-14-11-19-16(13-8-6-5-7-9-13)15-12(2)21-22(3)17(15)20-14/h1,5-9H,10-11H2,2-3H3,(H,18,20)