1-[3-oxidanylidene-2-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-1H-pyrazol-5-yl]-3-phenyl-urea

Systemtic Name: 1-[3-oxidanylidene-2-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-1H-pyrazol-5-yl]-3-phenyl-urea Openeye Name: 1-[3-oxo-2-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-1H-pyrazol-5-yl]-3-phenyl-urea CAS Name: 1-[3-oxo-2-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-1H-pyrazol-5-yl]-3-phenylurea IUPAC Name: 1-[3-oxo-2-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-1H-pyrazol-5-yl]-3-phenylurea Traditional Name: 1-[5-keto-1-phenyl-4-(3,4,5,6-tetrahydro-2H-azepin-7-yl)-3-pyrazolin-3-yl]-3-phenyl-urea Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)C2=C(NN(C2=O)C3=CC=CC=C3)NC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCC(=NCC1)C2=C(NN(C2=O)C3=CC=CC=C3)NC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H23N5O2/c28-21-19(18-14-8-3-9-15-23-18)20(26-27(21)17-12-6-2-7-13-17)25-22(29)24-16-10-4-1-5-11-16/h1-2,4-7,10-13,26H,3,8-9,14-15H2,(H2,24,25,29)