1-(3,4-dimethylphenyl)-3-phthalazin-5-yl-thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-phthalazin-5-yl-thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-phthalazin-5-yl-thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-(5-phthalazinyl)thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-phthalazin-5-ylthiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-phthalazin-5-yl-thiourea Formula: C17H16N4S MolecularWeight: 308.40074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=CC=CC3=CN=NC=C32)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=CC=CC3=CN=NC=C32)C

InChI

InChI=1S/C17H16N4S/c1-11-6-7-14(8-12(11)2)20-17(22)21-16-5-3-4-13-9-18-19-10-15(13)16/h3-10H,1-2H3,(H2,20,21,22)