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

Systemtic Name: 1-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]-3-propyl-thiourea Openeye Name: 1-[(4-oxo-3-propyl-phthalazine-1-carbonyl)amino]-3-propyl-thiourea CAS Name: 1-[[oxo-(4-oxo-3-propyl-1-phthalazinyl)methyl]amino]-3-propylthiourea IUPAC Name: 1-[(4-oxo-3-propylphthalazine-1-carbonyl)amino]-3-propylthiourea Traditional Name: 1-[(4-keto-3-propyl-phthalazine-1-carbonyl)amino]-3-propyl-thiourea Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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