pyridin-3-ylmethyl N-[[4-[(4-azanyl-1-thiophen-3-yl-pyrazol-3-yl)carbamoyl]phenyl]methyl]carbamate

Systemtic Name: pyridin-3-ylmethyl N-[[4-[(4-azanyl-1-thiophen-3-yl-pyrazol-3-yl)carbamoyl]phenyl]methyl]carbamate Openeye Name: 3-pyridylmethyl N-[[4-[[4-amino-1-(3-thienyl)pyrazol-3-yl]carbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[[4-amino-1-(3-thiophenyl)-3-pyrazolyl]amino]-oxomethyl]phenyl]methyl]carbamic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl N-[[4-[(4-amino-1-thiophen-3-ylpyrazol-3-yl)carbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[[4-amino-1-(3-thienyl)pyrazol-3-yl]carbamoyl]benzyl]carbamic acid 3-pyridylmethyl ester Formula: C22H20N6O3S MolecularWeight: 448.4976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)NC3=NN(C=C3N)C4=CSC=C4

Isomeric SMILES

C1=CC(=CN=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)NC3=NN(C=C3N)C4=CSC=C4

InChI

InChI=1S/C22H20N6O3S/c23-19-12-28(18-7-9-32-14-18)27-20(19)26-21(29)17-5-3-15(4-6-17)11-25-22(30)31-13-16-2-1-8-24-10-16/h1-10,12,14H,11,13,23H2,(H,25,30)(H,26,27,29)