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

Systemtic Name: 1-[1-(6-bromanylphthalazin-1-yl)piperidin-4-yl]-3-(4-cyanophenyl)thiourea Openeye Name: 1-[1-(6-bromophthalazin-1-yl)-4-piperidyl]-3-(4-cyanophenyl)thiourea CAS Name: 1-[1-(6-bromo-1-phthalazinyl)-4-piperidinyl]-3-(4-cyanophenyl)thiourea IUPAC Name: 1-[1-(6-bromophthalazin-1-yl)piperidin-4-yl]-3-(4-cyanophenyl)thiourea Traditional Name: 1-[1-(6-bromophthalazin-1-yl)-4-piperidyl]-3-(4-cyanophenyl)thiourea Formula: C21H19BrN6S MolecularWeight: 467.38476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrN6S/c22-16-3-6-19-15(11-16)13-24-27-20(19)28-9-7-18(8-10-28)26-21(29)25-17-4-1-14(12-23)2-5-17/h1-6,11,13,18H,7-10H2,(H2,25,26,29)