1-(2-dimethylaminoethyl)-3-[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]thiourea

Systemtic Name: 1-(2-dimethylaminoethyl)-3-[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]thiourea Openeye Name: 1-(2-dimethylaminoethyl)-3-[(4-oxo-3-pentyl-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-(2-dimethylaminoethyl)-3-[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]amino]thiourea IUPAC Name: 1-(2-dimethylaminoethyl)-3-[(4-oxo-3-pentylphthalazine-1-carbonyl)amino]thiourea Traditional Name: 1-[(3-amyl-4-keto-phthalazine-1-carbonyl)amino]-3-(2-dimethylaminoethyl)thiourea Formula: C19H28N6O2S MolecularWeight: 404.52962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NCCN(C)C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NCCN(C)C

InChI

InChI=1S/C19H28N6O2S/c1-4-5-8-12-25-18(27)15-10-7-6-9-14(15)16(23-25)17(26)21-22-19(28)20-11-13-24(2)3/h6-7,9-10H,4-5,8,11-13H2,1-3H3,(H,21,26)(H2,20,22,28)