N-[1-[[4-(azepan-1-ylcarbonyl)phenyl]methylamino]-1-oxidanylidene-propan-2-yl]furan-3-carboxamide

Systemtic Name: N-[1-[[4-(azepan-1-ylcarbonyl)phenyl]methylamino]-1-oxidanylidene-propan-2-yl]furan-3-carboxamide Openeye Name: N-[2-[[4-(azepane-1-carbonyl)phenyl]methylamino]-1-methyl-2-oxo-ethyl]furan-3-carboxamide CAS Name: N-[1-[[4-[1-azepanyl(oxo)methyl]phenyl]methylamino]-1-oxopropan-2-yl]-3-furancarboxamide IUPAC Name: N-[1-[[4-(azepane-1-carbonyl)phenyl]methylamino]-1-oxopropan-2-yl]furan-3-carboxamide Traditional Name: N-[2-[[4-(azepane-1-carbonyl)benzyl]amino]-2-keto-1-methyl-ethyl]-3-furamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)C(=O)N2CCCCCC2)NC(=O)C3=COC=C3

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)C(=O)N2CCCCCC2)NC(=O)C3=COC=C3

InChI

InChI=1S/C22H27N3O4/c1-16(24-21(27)19-10-13-29-15-19)20(26)23-14-17-6-8-18(9-7-17)22(28)25-11-4-2-3-5-12-25/h6-10,13,15-16H,2-5,11-12,14H2,1H3,(H,23,26)(H,24,27)