1-ethyl-3-[[3-(2-methylpropyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]thiourea

Systemtic Name: 1-ethyl-3-[[3-(2-methylpropyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]thiourea Openeye Name: 1-ethyl-3-[(3-isobutyl-4-oxo-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-ethyl-3-[[[3-(2-methylpropyl)-4-oxo-1-phthalazinyl]-oxomethyl]amino]thiourea IUPAC Name: 1-ethyl-3-[[3-(2-methylpropyl)-4-oxophthalazine-1-carbonyl]amino]thiourea Traditional Name: 1-ethyl-3-[(3-isobutyl-4-keto-phthalazine-1-carbonyl)amino]thiourea Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC(C)C

Isomeric SMILES

CCNC(=S)NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC(C)C

InChI

InChI=1S/C16H21N5O2S/c1-4-17-16(24)19-18-14(22)13-11-7-5-6-8-12(11)15(23)21(20-13)9-10(2)3/h5-8,10H,4,9H2,1-3H3,(H,18,22)(H2,17,19,24)