1-[(1S)-1-(1-adamantyl)propyl]-3-(5-chloranyl-2-methoxy-phenyl)urea

Systemtic Name: 1-[(1S)-1-(1-adamantyl)propyl]-3-(5-chloranyl-2-methoxy-phenyl)urea Openeye Name: 1-[(1S)-1-(1-adamantyl)propyl]-3-(5-chloro-2-methoxy-phenyl)urea CAS Name: 1-[(1S)-1-(1-adamantyl)propyl]-3-(5-chloro-2-methoxyphenyl)urea IUPAC Name: 1-[(1S)-1-(1-adamantyl)propyl]-3-(5-chloro-2-methoxyphenyl)urea Traditional Name: 1-[(1S)-1-(1-adamantyl)propyl]-3-(5-chloro-2-methoxy-phenyl)urea Formula: C21H29ClN2O2 MolecularWeight: 376.92016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)NC4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CC[C@@H](C12CC3CC(C1)CC(C3)C2)NC(=O)NC4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C21H29ClN2O2/c1-3-19(21-10-13-6-14(11-21)8-15(7-13)12-21)24-20(25)23-17-9-16(22)4-5-18(17)26-2/h4-5,9,13-15,19H,3,6-8,10-12H2,1-2H3,(H2,23,24,25)/t13?,14?,15?,19-,21?/m0/s1