1-(1-adamantyl)-3-[[4-[bis(azanyl)methylideneamino]phenyl]methyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[[4-[bis(azanyl)methylideneamino]phenyl]methyl]urea Openeye Name: 1-(1-adamantyl)-3-[(4-guanidinophenyl)methyl]urea CAS Name: 1-(1-adamantyl)-3-[[4-(diaminomethylideneamino)phenyl]methyl]urea IUPAC Name: 1-(1-adamantyl)-3-[[4-(diaminomethylideneamino)phenyl]methyl]urea Traditional Name: 1-(1-adamantyl)-3-(4-guanidinobenzyl)urea Formula: C19H27N5O MolecularWeight: 341.45058

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NCC4=CC=C(C=C4)N=C(N)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NCC4=CC=C(C=C4)N=C(N)N

InChI

InChI=1S/C19H27N5O/c20-17(21)23-16-3-1-12(2-4-16)11-22-18(25)24-19-8-13-5-14(9-19)7-15(6-13)10-19/h1-4,13-15H,5-11H2,(H4,20,21,23)(H2,22,24,25)