1-[bis(azanyl)methylideneamino]-3-[(4-butoxyphenyl)methyl]thiourea

Systemtic Name: 1-[bis(azanyl)methylideneamino]-3-[(4-butoxyphenyl)methyl]thiourea Openeye Name: 1-[(4-butoxyphenyl)methyl]-3-guanidino-thiourea CAS Name: 1-[(4-butoxyphenyl)methyl]-3-(diaminomethylideneamino)thiourea IUPAC Name: 1-[(4-butoxyphenyl)methyl]-3-(diaminomethylideneamino)thiourea Traditional Name: 1-(4-butoxybenzyl)-3-guanidino-thiourea Formula: C13H21N5OS MolecularWeight: 295.40374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CNC(=S)NN=C(N)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CNC(=S)NN=C(N)N

InChI

InChI=1S/C13H21N5OS/c1-2-3-8-19-11-6-4-10(5-7-11)9-16-13(20)18-17-12(14)15/h4-7H,2-3,8-9H2,1H3,(H4,14,15,17)(H2,16,18,20)