1-[2-(aminocarbonylamino)propyl]-3-[1-[(1-azanyl-4-methyl-pentan-2-yl)carbamoylamino]-3-phenyl-propan-2-yl]urea

Systemtic Name: 1-[2-(aminocarbonylamino)propyl]-3-[1-[(1-azanyl-4-methyl-pentan-2-yl)carbamoylamino]-3-phenyl-propan-2-yl]urea Openeye Name: 1-[1-(aminomethyl)-3-methyl-butyl]-3-[3-phenyl-2-(2-ureidopropylcarbamoylamino)propyl]urea CAS Name: 1-(1-amino-4-methylpentan-2-yl)-3-[2-[[[2-(carbamoylamino)propylamino]-oxomethyl]amino]-3-phenylpropyl]urea IUPAC Name: 1-(1-amino-4-methylpentan-2-yl)-3-[2-[2-(carbamoylamino)propylcarbamoylamino]-3-phenylpropyl]urea Traditional Name: 1-[1-(aminomethyl)-3-methyl-butyl]-3-[3-phenyl-2-(2-ureidopropylcarbamoylamino)propyl]urea Formula: C21H37N7O3 MolecularWeight: 435.56358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CN)NC(=O)NCC(CC1=CC=CC=C1)NC(=O)NCC(C)NC(=O)N

Isomeric SMILES

CC(C)CC(CN)NC(=O)NCC(CC1=CC=CC=C1)NC(=O)NCC(C)NC(=O)N

InChI

InChI=1S/C21H37N7O3/c1-14(2)9-17(11-22)27-21(31)25-13-18(10-16-7-5-4-6-8-16)28-20(30)24-12-15(3)26-19(23)29/h4-8,14-15,17-18H,9-13,22H2,1-3H3,(H3,23,26,29)(H2,24,28,30)(H2,25,27,31)