prop-2-ynyl N-[[4-[2-[(6-azanyl-2-methyl-pyridin-3-yl)methylamino]-2-oxidanylidene-ethyl]-5-methyl-3-oxidanylidene-pyrazin-2-yl]amino]carbamate

Systemtic Name: prop-2-ynyl N-[[4-[2-[(6-azanyl-2-methyl-pyridin-3-yl)methylamino]-2-oxidanylidene-ethyl]-5-methyl-3-oxidanylidene-pyrazin-2-yl]amino]carbamate Openeye Name: prop-2-ynyl N-[[4-[2-[(6-amino-2-methyl-3-pyridyl)methylamino]-2-oxo-ethyl]-5-methyl-3-oxo-pyrazin-2-yl]amino]carbamate CAS Name: N-[[4-[2-[(6-amino-2-methyl-3-pyridinyl)methylamino]-2-oxoethyl]-5-methyl-3-oxo-2-pyrazinyl]amino]carbamic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl N-[[4-[2-[(6-amino-2-methylpyridin-3-yl)methylamino]-2-oxoethyl]-5-methyl-3-oxopyrazin-2-yl]amino]carbamate Traditional Name: N-[[4-[2-[(6-amino-2-methyl-3-pyridyl)methylamino]-2-keto-ethyl]-3-keto-5-methyl-pyrazin-2-yl]amino]carbamic acid propargyl ester Formula: C18H21N7O4 MolecularWeight: 399.40384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=O)N1CC(=O)NCC2=C(N=C(C=C2)N)C)NNC(=O)OCC#C

Isomeric SMILES

CC1=CN=C(C(=O)N1CC(=O)NCC2=C(N=C(C=C2)N)C)NNC(=O)OCC#C

InChI

InChI=1S/C18H21N7O4/c1-4-7-29-18(28)24-23-16-17(27)25(11(2)8-21-16)10-15(26)20-9-13-5-6-14(19)22-12(13)3/h1,5-6,8H,7,9-10H2,2-3H3,(H2,19,22)(H,20,26)(H,21,23)(H,24,28)