pentyl N'-(prop-1-en-2-ylamino)carbamimidothioate

Systemtic Name: pentyl N'-(prop-1-en-2-ylamino)carbamimidothioate Openeye Name: 3-(isopropenylamino)-2-pentyl-isothiourea CAS Name: N'-(1-methylethenylamino)carbamimidothioic acid pentyl ester IUPAC Name: pentyl N'-(prop-1-en-2-ylamino)carbamimidothioate Traditional Name: 2-amyl-3-(isopropenylamino)isothiourea Formula: C9H19N3S MolecularWeight: 201.33226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC(=NNC(=C)C)N

Isomeric SMILES

CCCCCS/C(=N\NC(=C)C)/N

InChI

InChI=1S/C9H19N3S/c1-4-5-6-7-13-9(10)12-11-8(2)3/h11H,2,4-7H2,1,3H3,(H2,10,12)