1-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]-3-[3-(methylthio)propyl]thiourea Formula: C16H21N5O2S2 MolecularWeight: 379.50024

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NCCCSC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NCCCSC

InChI

InChI=1S/C16H21N5O2S2/c1-3-21-15(23)12-8-5-4-7-11(12)13(20-21)14(22)18-19-16(24)17-9-6-10-25-2/h4-5,7-8H,3,6,9-10H2,1-2H3,(H,18,22)(H2,17,19,24)