N-[4-[(1-imidazol-1-yl-3,3-dimethyl-butan-2-yl)carbamoylamino]phenyl]oxolane-2-carboxamide

Systemtic Name: N-[4-[(1-imidazol-1-yl-3,3-dimethyl-butan-2-yl)carbamoylamino]phenyl]oxolane-2-carboxamide Openeye Name: N-[4-[[1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]carbamoylamino]phenyl]tetrahydrofuran-2-carboxamide CAS Name: N-[4-[[[[1-(1-imidazolyl)-3,3-dimethylbutan-2-yl]amino]-oxomethyl]amino]phenyl]-2-oxolanecarboxamide IUPAC Name: N-[4-[(1-imidazol-1-yl-3,3-dimethylbutan-2-yl)carbamoylamino]phenyl]oxolane-2-carboxamide Traditional Name: N-[4-[[1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]carbamoylamino]phenyl]tetrahydrofuran-2-carboxamide Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1C=CN=C1)NC(=O)NC2=CC=C(C=C2)NC(=O)C3CCCO3

Isomeric SMILES

CC(C)(C)C(CN1C=CN=C1)NC(=O)NC2=CC=C(C=C2)NC(=O)C3CCCO3

InChI

InChI=1S/C21H29N5O3/c1-21(2,3)18(13-26-11-10-22-14-26)25-20(28)24-16-8-6-15(7-9-16)23-19(27)17-5-4-12-29-17/h6-11,14,17-18H,4-5,12-13H2,1-3H3,(H,23,27)(H2,24,25,28)