1-[1-(6-bromanylphthalazin-1-yl)piperidin-4-yl]-3-(3-bromophenyl)thiourea

Systemtic Name: 1-[1-(6-bromanylphthalazin-1-yl)piperidin-4-yl]-3-(3-bromophenyl)thiourea Openeye Name: 1-(3-bromophenyl)-3-[1-(6-bromophthalazin-1-yl)-4-piperidyl]thiourea CAS Name: 1-(3-bromophenyl)-3-[1-(6-bromo-1-phthalazinyl)-4-piperidinyl]thiourea IUPAC Name: 1-(3-bromophenyl)-3-[1-(6-bromophthalazin-1-yl)piperidin-4-yl]thiourea Traditional Name: 1-(3-bromophenyl)-3-[1-(6-bromophthalazin-1-yl)-4-piperidyl]thiourea Formula: C20H19Br2N5S MolecularWeight: 521.27136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=S)NC2=CC(=CC=C2)Br)C3=C4C=CC(=CC4=CN=N3)Br

Isomeric SMILES

C1CN(CCC1NC(=S)NC2=CC(=CC=C2)Br)C3=C4C=CC(=CC4=CN=N3)Br

InChI

InChI=1S/C20H19Br2N5S/c21-14-2-1-3-17(11-14)25-20(28)24-16-6-8-27(9-7-16)19-18-5-4-15(22)10-13(18)12-23-26-19/h1-5,10-12,16H,6-9H2,(H2,24,25,28)