1-[[4-[[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]carbamoyl]phenyl]methyl]-3-propan-2-yl-urea

Systemtic Name: 1-[[4-[[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]carbamoyl]phenyl]methyl]-3-propan-2-yl-urea Openeye Name: 1-isopropyl-3-[[4-[[[2-(2-oxoazepan-1-yl)acetyl]amino]carbamoyl]phenyl]methyl]urea CAS Name: 1-[[4-[oxo-[[1-oxo-2-(2-oxo-1-azepanyl)ethyl]hydrazo]methyl]phenyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-[[4-[[[2-(2-oxoazepan-1-yl)acetyl]amino]carbamoyl]phenyl]methyl]-3-propan-2-ylurea Traditional Name: 1-isopropyl-3-[4-[[[2-(2-ketoazepan-1-yl)acetyl]amino]carbamoyl]benzyl]urea Formula: C20H29N5O4 MolecularWeight: 403.47536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NNC(=O)CN2CCCCCC2=O

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NNC(=O)CN2CCCCCC2=O

InChI

InChI=1S/C20H29N5O4/c1-14(2)22-20(29)21-12-15-7-9-16(10-8-15)19(28)24-23-17(26)13-25-11-5-3-4-6-18(25)27/h7-10,14H,3-6,11-13H2,1-2H3,(H,23,26)(H,24,28)(H2,21,22,29)